Detailed information for compound 1274457

Basic information

Technical information
  • TDR Targets ID: 1274457
  • Name: (1S,2S)-2-[(S)-[di(phenyl)phosphorylamino]-ph enylmethyl]-N-[(5-methylfuran-2-yl)methyl]cyc lopropane-1-carboxamide
  • MW: 484.526 | Formula: C29H29N2O3P
  • H donors: 2 H acceptors: 2 LogP: 4.45 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(o1)CNC(=O)[C@H]1C[C@@H]1[C@@H](c1ccccc1)NP(=O)(c1ccccc1)c1ccccc1
  • InChi: 1S/C29H29N2O3P/c1-21-17-18-23(34-21)20-30-29(32)27-19-26(27)28(22-11-5-2-6-12-22)31-35(33,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-18,26-28H,19-20H2,1H3,(H,30,32)(H,31,33)/t26-,27-,28+/m0/s1
  • InChiKey: AMEKFZSDKNRZRL-HZFUHODCSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (1S,2S)-2-[(S)-[di(phenyl)phosphorylamino]-phenyl-methyl]-N-[(5-methyl-2-furyl)methyl]cyclopropane-1-carboxamide
  • (1S,2S)-2-[(S)-[di(phenyl)phosphorylamino]-phenylmethyl]-N-[(5-methyl-2-furyl)methyl]-1-cyclopropanecarboxamide
  • (1S,2S)-2-[(S)-[di(phenyl)phosphorylamino]-phenyl-methyl]-N-[(5-methylfuran-2-yl)methyl]cyclopropane-1-carboxamide
  • MLS000563743
  • SMR000388815
  • CMLD4_000273
  • SDCCGMLS-0091074.P001
  • UPCMLD04ASTW002128
  • NCGC00074241-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cytochrome P450, family 3, subfamily A, polypeptide 4 Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 19 Starlite/ChEMBL No references
Homo sapiens hydroxyprostaglandin dehydrogenase 15-(NAD) Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens microtubule-associated protein tau Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Homo sapiens cytochrome P450, family 2, subfamily C, polypeptide 9 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans cytochrome P450 556 Get druggable targets OG5_126554 All targets in OG5_126554
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K04380 microtubule-associated protein tau, putative Get druggable targets OG5_133504 All targets in OG5_133504
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126582 All targets in OG5_126582
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni microtubule-associated protein tau Get druggable targets OG5_133504 All targets in OG5_133504
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Leishmania major cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma congolense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Candida albicans cytochrome P450 56 Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania donovani cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans closely related to C.maltosa N-alkane-inducible cytochrome P-450, alkane hydroxylating monooxygenase CYP52A3-b aka P450Alk1A (BA Get druggable targets OG5_126554 All targets in OG5_126554
Echinococcus multilocularis microtubule associated protein 2 Get druggable targets OG5_133504 All targets in OG5_133504
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Loa Loa (eye worm) CYP4Cod1 Get druggable targets OG5_126554 All targets in OG5_126554
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana cytochrome p450-like protein Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 Get druggable targets OG5_126554 All targets in OG5_126554
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to C.maltosa N-alkane inducible cytochrome P-450, ALK8 CYP52A11 Get druggable targets OG5_126554 All targets in OG5_126554
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi cytochrome P450, putative Get druggable targets OG5_126554 All targets in OG5_126554
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi Cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) cytochrome P450 family protein Get druggable targets OG5_126554 All targets in OG5_126554
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum steroid dehydrogenase, putative hydroxyprostaglandin dehydrogenase 15-(NAD) 266 aa 216 aa 22.2 %
Leishmania major cytochrome p450-like protein cytochrome P450, family 2, subfamily C, polypeptide 19 490 aa 411 aa 23.1 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 cytochrome P450, family 2, subfamily C, polypeptide 9 490 aa 441 aa 21.8 %
Brugia malayi cytochrome P450 cytochrome P450, family 3, subfamily A, polypeptide 4 502 aa 492 aa 24.2 %
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus multilocularis Phospholipase carboxylesterase 0.0025 0.0015 0.0022
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0193 0.0298
Mycobacterium tuberculosis Probable amidase AmiB2 (aminohydrolase) 0.0076 0.0416 0.1247
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0191 0.1329 0.1329
Mycobacterium ulcerans amidase 0.0076 0.0416 0.1288
Leishmania major hypothetical protein, conserved 0.0025 0.0015 0.0048
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.043 0.3229 1
Trypanosoma cruzi phosphoglycerate kinase, putative 0.007 0.037 0.1147
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0191 0.1329 0.3247
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0015 0.0015
Mycobacterium ulcerans peptide amidase, GatA 0.0076 0.0416 0.1288
Brugia malayi putative neuropeptide receptor 0.0024 0.0001 0.0003
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.043 0.3229 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus granulosus fatty acid amide hydrolase 1 0.0076 0.0416 0.0644
Schistosoma mansoni hypothetical protein 0.0205 0.144 0.2236
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Serotonin receptor 0.0024 0.0001 0.0003
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0191 0.1329 0.4089
Toxoplasma gondii phosphoglycerate kinase PGKII 0.0191 0.1329 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0193 0.0298
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Plasmodium falciparum glutamyl-tRNA(Gln) amidotransferase subunit A 0.0076 0.0416 0.1247
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0076 0.0416 0.0644
Loa Loa (eye worm) hypothetical protein 0.0069 0.0365 0.0365
Loa Loa (eye worm) hypothetical protein 0.0025 0.0015 0.0015
Mycobacterium tuberculosis Possible amidase (aminohydrolase) 0.0076 0.0416 0.1247
Onchocerca volvulus 0.0024 0.0001 0.5
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Mycobacterium tuberculosis Probable amidase AmiC (aminohydrolase) 0.0076 0.0416 0.1247
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.007 0.037 0.1147
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0191 0.1329 0.4117
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0193 0.0193
Trichomonas vaginalis valacyclovir hydrolase, putative 0.043 0.3229 1
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0024 0.0001 0.0003
Plasmodium falciparum lysophospholipase, putative 0.043 0.3229 1
Brugia malayi larval opioid receptor 0.0024 0.0001 0.0003
Brugia malayi Phosphoglycerate kinase 0.0191 0.1329 0.2767
Trypanosoma brucei Serine peptidase, Clan SC, Family S09X 0.0025 0.0015 0.0048
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0397 0.1228
Plasmodium falciparum phosphoglycerate kinase 0.0191 0.1329 0.4089
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0024 0.0001 0.0003
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0193 0.0298
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Brugia malayi Cytochrome P450 family protein 0.0059 0.0282 0.0587
Trypanosoma cruzi Serine peptidase, Clan SC, Family S09X, putative 0.0025 0.0015 0.0048
Chlamydia trachomatis phosphoglycerate kinase 0.0191 0.1329 1
Brugia malayi Dopamine receptor protein 1 0.0024 0.0001 0.0003
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0024 0.0001 0.0003
Trypanosoma brucei Alpha/beta hydrolase family, putative 0.0025 0.0015 0.0048
Echinococcus granulosus GA binding protein alpha chain 0.0081 0.0459 0.0711
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Brugia malayi Tachykinin-like peptides receptor 99D 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Schistosoma mansoni hypothetical protein 0.0205 0.144 0.2236
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Mycobacterium ulcerans aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0076 0.0416 0.1288
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0024 0.0001 0.0003
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0015 0.0015
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0193 0.0298
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0193 0.0298
Trypanosoma brucei phosphoglycerate kinase 0.007 0.037 0.1147
Brugia malayi MGC83647 protein 0.0025 0.0015 0.0032
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0025 0.0015 0.0048
Brugia malayi Phosphoglycerate kinase 0.007 0.037 0.0771
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0397 0.0614
Schistosoma mansoni amidase 0.0628 0.4805 0.7465
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Dopamine receptor 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Serotonin receptor 0.0024 0.0001 0.0003
Trypanosoma cruzi serine peptidase, putative 0.0025 0.0015 0.0048
Mycobacterium tuberculosis Probable amidase AmiD (acylamidase) (acylase) 0.0076 0.0416 0.1247
Leishmania major hypothetical protein, conserved 0.0025 0.0015 0.0048
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0024 0.0001 0.0001
Toxoplasma gondii phosphoglycerate kinase PGKI 0.0191 0.1329 1
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.1282 1 1
Leishmania major phosphoglycerate kinase C, glycosomal 0.0191 0.1329 0.4117
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Schistosoma mansoni glutamyl-tRNA(Gln) amidotransferase subunit A 0.0076 0.0416 0.0644
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Schistosoma mansoni fatty-acid amide hydrolase 0.0076 0.0416 0.0644
Brugia malayi putative amidase 0.0076 0.0416 0.0866
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Schistosoma mansoni family S9 unassigned peptidase (S09 family) 0.0025 0.0015 0.0022
Brugia malayi MGC79044 protein 0.0025 0.0015 0.0032
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0193 0.0298
Loa Loa (eye worm) neuropeptide F receptor 0.0024 0.0001 0.0001
Echinococcus granulosus geminin 0.0205 0.144 0.2236
Loa Loa (eye worm) fli-1 protein 0.0246 0.1772 0.1772
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0191 0.1329 0.4117
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Trypanosoma brucei phosphoglycerate kinase 0.0191 0.1329 0.4117
Mycobacterium ulcerans amidase 0.0076 0.0416 0.1288
Echinococcus granulosus microtubule associated protein 2 0.0833 0.6435 1
Trypanosoma brucei Alpha/beta hydrolase family, putative 0.0025 0.0015 0.0048
Schistosoma mansoni microtubule-associated protein tau 0.0833 0.6435 1
Brugia malayi Dopamine receptor protein 2 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus multilocularis abhydrolase domain containing 3 0.0025 0.0015 0.0022
Mycobacterium ulcerans phosphoglycerate kinase 0.0191 0.1329 0.4117
Brugia malayi follicle stimulating hormone receptor 0.0301 0.2209 0.4597
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi neuropeptide F receptor 0.0024 0.0001 0.0003
Mycobacterium ulcerans amidase 0.0076 0.0416 0.1288
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus multilocularis geminin 0.0205 0.144 0.2236
Schistosoma mansoni peptidase 0.0025 0.0015 0.0022
Onchocerca volvulus 0.0024 0.0001 0.5
Brugia malayi neuropeptide F receptor 0.0024 0.0001 0.0003
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) hypothetical protein 0.0025 0.0015 0.0015
Echinococcus granulosus abhydrolase domain containing 3 0.0025 0.0015 0.0022
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.007 0.037 0.1147
Trypanosoma cruzi amidase, putative 0.0076 0.0416 0.1288
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.0397 0.0614
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.0397 0.0614
Mycobacterium ulcerans hydrolase 0.0025 0.0015 0.0048
Echinococcus granulosus abhydrolase domain containing protein 13 0.0025 0.0015 0.0022
Onchocerca volvulus 0.0024 0.0001 0.5
Brugia malayi RE15519p 0.0024 0.0001 0.0003
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0397 0.1228
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0628 0.4805 0.7465
Onchocerca volvulus 0.0024 0.0001 0.5
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0076 0.0416 0.0644
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Brugia malayi G protein-coupled receptor F59B2.13 0.0024 0.0001 0.0003
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.0397 0.1228
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus granulosus phosphoglycerate kinase 1 0.0191 0.1329 0.2064
Brugia malayi G-protein coupled receptor 0.0024 0.0001 0.0003
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0193 0.0402
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.043 0.3229 1
Loa Loa (eye worm) TYRA-2 protein 0.0024 0.0001 0.0001
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0025 0.0015 0.0015
Leishmania major hypothetical protein, conserved 0.0076 0.0416 0.1288
Brugia malayi Ets-domain containing protein 0.0081 0.0459 0.0955
Plasmodium falciparum esterase, putative 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.043 0.3229 1
Trypanosoma cruzi monoglyceride lipase, putative 0.043 0.3229 1
Brugia malayi ORL1-like opioid receptor 0.0024 0.0001 0.0003
Onchocerca volvulus 0.0024 0.0001 0.5
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.0397 0.1187
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0301 0.2209 0.2209
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Plasmodium vivax phosphoglycerate kinase, putative 0.0191 0.1329 0.4089
Trypanosoma cruzi serine peptidase, putative 0.0025 0.0015 0.0048
Schistosoma mansoni family S9 unassigned peptidase (S09 family) 0.0025 0.0015 0.0022
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Brugia malayi AKH receptor 0.0024 0.0001 0.0003
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0191 0.1329 0.4089
Plasmodium falciparum lysophospholipase, putative 0.043 0.3229 1
Plasmodium vivax glutamyl-tRNA(Gln) amidotransferase subunit A, putative 0.0076 0.0416 0.1247
Onchocerca volvulus 0.0024 0.0001 0.5
Brugia malayi putative neuropeptide receptor NPR1 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Melatonin receptor type 1A 0.0024 0.0001 0.0003
Trypanosoma brucei phosphoglycerate kinase, putative 0.007 0.037 0.1147
Trypanosoma cruzi 3-phosphoglycerate kinase, glycosomal 0.007 0.037 0.1147
Schistosoma mansoni phosphoglycerate kinase 0.0191 0.1329 0.2064
Schistosoma mansoni ets-related 0.0246 0.1772 0.2751
Brugia malayi GnHR receptor homolog 0.0024 0.0001 0.0003
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.007 0.037 0.1147
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Ets-domain containing protein 0.0081 0.0459 0.0955
Brugia malayi Amidase family protein 0.0076 0.0416 0.0866
Echinococcus multilocularis monoacylglycerol lipase abhd12 0.0025 0.0015 0.0022
Echinococcus granulosus fatty acid amide hydrolase 1 0.0628 0.4805 0.7465
Leishmania major monoglyceride lipase, putative 0.043 0.3229 1
Giardia lamblia Phosphoglycerate kinase 0.0191 0.1329 1
Loa Loa (eye worm) neuropeptide F receptor 0.0024 0.0001 0.0001
Brugia malayi amidase 0.0628 0.4805 1
Onchocerca volvulus Neuropeptide F receptor homolog 0.0024 0.0001 0.5
Brugia malayi G protein-coupled receptor 0.0024 0.0001 0.0003
Trypanosoma brucei fatty-acid amide hydrolase, putative 0.0076 0.0416 0.1288
Plasmodium falciparum lysophospholipase, putative 0.043 0.3229 1
Brugia malayi sulfakinin receptor protein 0.0024 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0076 0.0416 0.0644
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0025 0.0015 0.0048
Echinococcus multilocularis phosphoglycerate kinase 1 0.0191 0.1329 0.2064
Leishmania major phosphoglycerate kinase B, cytosolic 0.0191 0.1329 0.4117
Echinococcus granulosus monoacylglycerol lipase abhd12 0.0025 0.0015 0.0022
Onchocerca volvulus 0.0024 0.0001 0.5
Mycobacterium ulcerans amidase 0.0076 0.0416 0.1288
Plasmodium vivax PST-A protein 0.043 0.3229 1
Echinococcus granulosus fatty acid amide hydrolase 1 0.0628 0.4805 0.7465
Trypanosoma brucei monoglyceride lipase, putative 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0193 0.0298
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) hypothetical protein 0.0628 0.4805 0.4805
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0191 0.1329 1
Entamoeba histolytica phosphoglycerate kinase, putative 0.0191 0.1329 0.4089
Leishmania major Bem46-like serine peptidase,Serine peptidase, Clan SC, Family S09X 0.0025 0.0015 0.0048
Onchocerca volvulus 0.0024 0.0001 0.5
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0081 0.0459 0.0459
Trypanosoma cruzi phosphoglycerate kinase, putative 0.007 0.037 0.1147
Treponema pallidum phosphoglycerate kinase 0.0191 0.1329 1
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0024 0.0001 0.5
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.0397 0.2902
Mycobacterium tuberculosis Possible lysophospholipase 0.043 0.3229 1
Loa Loa (eye worm) G-protein coupled receptor 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi Amidase family protein 0.0076 0.0416 0.0866
Brugia malayi G-protein coupled receptor 0.0024 0.0001 0.0003
Trypanosoma brucei phosphoglycerate kinase 0.0191 0.1329 0.4117
Mycobacterium ulcerans hypothetical protein 0.043 0.3229 1
Echinococcus granulosus Phospholipase carboxylesterase 0.0025 0.0015 0.0022
Mycobacterium ulcerans hypothetical protein 0.0025 0.0015 0.0048
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.0397 0.1228
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0024 0.0001 0.0001
Schistosoma mansoni gabp alpha 0.0081 0.0459 0.0711
Echinococcus multilocularis GA binding protein alpha chain 0.0081 0.0459 0.0711
Loa Loa (eye worm) amidase 0.0076 0.0416 0.0416
Trypanosoma cruzi amidase, putative 0.0076 0.0416 0.1288
Echinococcus multilocularis microtubule associated protein 2 0.0833 0.6435 1
Mycobacterium ulcerans hypothetical protein 0.0025 0.0015 0.0048
Schistosoma mansoni phosphoglycerate kinase 0.0191 0.1329 0.2064
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0628 0.4805 0.7465
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Loa Loa (eye worm) amidase 0.0076 0.0416 0.0416
Trypanosoma cruzi hydrolase, alpha/beta fold family, putative 0.0025 0.0015 0.0048
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.0397 0.0614
Loa Loa (eye worm) cytochrome P450 family protein 0.0059 0.0282 0.0282
Trichomonas vaginalis conserved hypothetical protein 0.043 0.3229 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Mycobacterium tuberculosis Probable amidase AmiA2 (aminohydrolase) 0.0076 0.0416 0.1247
Brugia malayi Fli-1 protein 0.0246 0.1772 0.3687
Loa Loa (eye worm) hypothetical protein 0.0024 0.0001 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.043 0.3229 1
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.043 0.3229 1
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0076 0.0416 0.3049
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0191 0.1329 0.4089
Mycobacterium ulcerans lysophospholipase 0.043 0.3229 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0024 0.0001 0.0001
Mycobacterium ulcerans amidase 0.0076 0.0416 0.1288
Trypanosoma cruzi Alpha/beta hydrolase family, putative 0.0025 0.0015 0.0048
Trypanosoma brucei monoglyceride lipase, putative 0.043 0.3229 1
Brugia malayi Protein C20orf22 0.0025 0.0015 0.0032
Onchocerca volvulus 0.0024 0.0001 0.5
Schistosoma mansoni fatty-acid amide hydrolase 0.0628 0.4805 0.7465
Onchocerca volvulus 0.0024 0.0001 0.5
Brugia malayi hypothetical protein 0.0024 0.0001 0.0003
Loa Loa (eye worm) G-protein coupled receptor 0.0024 0.0001 0.0001

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 5.011872336 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 10 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 12.58925412 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
AC50 (functional) = 31.6227766 uM PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active ChEMBL. No reference
Potency (binding) = 0.7943 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) 0.92 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.5119 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (ADMET) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (ADMET) = 5.0119 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (functional) 8.2753 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (ADMET) = 10 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2C9. (Class of assay: confirmatory) [Related pubchem assays: 885, 884, 410 ] ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.5821 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (ADMET) = 12.5893 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2C19. (Class of assay: confirmatory) [Related pubchem assays: 410 ] ChEMBL. No reference
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (binding) = 17.7828 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 22.3872 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 28.1838 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) 28.1838 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Bacillus subtilis Sfp phosphopantetheinyl transferase (PPTase). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 50.1187 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of Schistosoma Mansoni Peroxiredoxins. (Class of assay: confirmatory) [Related pubchem assays: 1011 (Confirmation Concentration-Response Assay for Inhibitors of the Schistosoma mansoni Redox Cascade ), 448 (Schistosoma Mansoni Peroxiredoxins (Prx2) and thioredoxin glutathione reductase (TGR) coupled assay)] ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) = 100 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
Plasmodium falciparum ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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