Detailed information for compound 254032

Basic information

Technical information
  • TDR Targets ID: 254032
  • Name: (4R)-5-oxo-5-(N-[2-oxo-2-(N-propan-2-ylanilin o)ethyl]anilino)-4-(phenylcarbamoylamino)pent anoic acid
  • MW: 516.588 | Formula: C29H32N4O5
  • H donors: 3 H acceptors: 5 LogP: 3.79 Rotable bonds: 15
    Rule of 5 violations (Lipinski): 2
  • SMILES: OC(=O)CC[C@H](C(=O)N(c1ccccc1)CC(=O)N(c1ccccc1)C(C)C)NC(=O)Nc1ccccc1
  • InChi: 1S/C29H32N4O5/c1-21(2)33(24-16-10-5-11-17-24)26(34)20-32(23-14-8-4-9-15-23)28(37)25(18-19-27(35)36)31-29(38)30-22-12-6-3-7-13-22/h3-17,21,25H,18-20H2,1-2H3,(H,35,36)(H2,30,31,38)/t25-/m1/s1
  • InChiKey: UYHYPASNCCHSSE-RUZDIDTESA-N  


Substructure search Similarity search

Network

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Synonyms

  • (4R)-5-(N-[2-(N-isopropylanilino)-2-oxo-ethyl]anilino)-5-oxo-4-(phenylcarbamoylamino)pentanoic acid
  • (4R)-4-[[anilino(oxo)methyl]amino]-5-(N-[2-(N-isopropylanilino)-2-oxoethyl]anilino)-5-oxopentanoic acid
  • (4R)-5-oxo-5-[[2-oxo-2-[phenyl(propan-2-yl)amino]ethyl]-phenyl-amino]-4-(phenylcarbamoylamino)pentanoic acid
  • (4R)-5-(N-[2-(N-isopropylanilino)-2-keto-ethyl]anilino)-5-keto-4-(phenylcarbamoylamino)valeric acid
  • (4R)-5-oxo-5-[[2-oxo-2-(phenyl-propan-2-ylamino)ethyl]-phenylamino]-4-(phenylcarbamoylamino)pentanoic acid
  • (4R)-5-[[2-(isopropyl-phenyl-amino)-2-oxo-ethyl]-phenyl-amino]-5-oxo-4-(phenylcarbamoylamino)pentanoic acid
  • (4R)-5-[[2-(isopropyl-phenylamino)-2-oxoethyl]-phenylamino]-5-oxo-4-[[oxo-(phenylamino)methyl]amino]pentanoic acid
  • (4R)-5-[[2-(isopropyl-phenyl-amino)-2-keto-ethyl]-phenyl-amino]-5-keto-4-(phenylcarbamoylamino)valeric acid
  • (4R)-5-oxo-5-[[2-oxo-2-(phenyl-propan-2-yl-amino)ethyl]-phenyl-amino]-4-(phenylcarbamoylamino)pentanoic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens cholecystokinin A receptor Starlite/ChEMBL No references
Homo sapiens cholecystokinin B receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132882 All targets in OG5_132882
Brugia malayi hypothetical protein Get druggable targets OG5_132882 All targets in OG5_132882
Brugia malayi sulfakinin receptor protein Get druggable targets OG5_132882 All targets in OG5_132882
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus rhodopsin orphan GPCR cholecystokinin A receptor 428 aa 373 aa 19.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis titin 0.0049 0.0038 0.0111
Loa Loa (eye worm) hypothetical protein 0.0071 0.0114 0.0114
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Brugia malayi Heparan sulfate 0.0062 0.0083 0.0083
Entamoeba histolytica acyl-CoA synthetase, putative 0.0095 0.0195 0.4584
Brugia malayi GMP reductase 0.0441 0.1352 0.1352
Echinococcus multilocularis leucine rich repeat containing protein 4 0.0062 0.0083 0.0242
Schistosoma mansoni cell adhesion molecule 0.0062 0.0083 0.0242
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Echinococcus granulosus low density lipoprotein receptor ldl 0.0062 0.0083 0.0242
Brugia malayi protein-tyrosine kinase 0.0183 0.0489 0.0489
Schistosoma mansoni chloride channel protein 0.0063 0.0086 0.0252
Echinococcus granulosus H:Cl exchange transporter 3 0.0063 0.0086 0.0252
Brugia malayi Prion-like- 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0037 0.0000081786 0.0000081786
Echinococcus granulosus tyrosine protein kinase Src42A 0.0165 0.0428 0.1247
Loa Loa (eye worm) loechrig isoform VII 0.0063 0.0086 0.0086
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus granulosus 3'partial|cell adhesion molecule:down regulated by 0.0062 0.0083 0.0242
Schistosoma mansoni septate junction protein 0.0111 0.0246 0.0717
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Brugia malayi kettin 0.0049 0.0038 0.0038
Schistosoma mansoni cell adhesion molecule 0.0049 0.0038 0.0111
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0067 0.0101 0.0044
Loa Loa (eye worm) hypothetical protein 0.0071 0.0114 0.0114
Loa Loa (eye worm) hypothetical protein 0.0062 0.0083 0.0083
Echinococcus multilocularis tyrosine protein kinase Blk 0.0183 0.0489 0.1426
Schistosoma mansoni nephrin 0.0169 0.0442 0.1289
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Schistosoma mansoni tyrosine kinase 0.0201 0.0551 0.1605
Schistosoma mansoni tyrosine kinase 0.0129 0.0307 0.0896
Loa Loa (eye worm) hypothetical protein 0.0183 0.0487 0.0487
Echinococcus granulosus roundabout 2 0.0231 0.065 0.1895
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0095 0.0195 0.0325
Echinococcus granulosus 5' AMP activated protein kinase subunit gamma 0.0063 0.0086 0.0252
Loa Loa (eye worm) hypothetical protein 0.0231 0.065 0.065
Echinococcus granulosus tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Giardia lamblia AAA family ATPase 0.0086 0.0163 1
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.0136 0.0331 0.0888
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0067 0.0101 0.0044
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0067 0.0101 0.0044
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0049 0.0038 0.0111
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0062 0.0083 0.0242
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Schistosoma mansoni tyrosine kinase 0.0056 0.0062 0.0179
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.0136 0.0331 0.078
Echinococcus multilocularis tyrosine protein kinase otk 0.0111 0.0246 0.0717
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0111 0.0246 0.0246
Echinococcus granulosus tyrosine protein kinase Lyn 0.0201 0.0551 0.1605
Mycobacterium ulcerans inosine 5'-monophosphate dehydrogenase 0.1061 0.343 1
Brugia malayi inosine-5'-monophosphate dehydrogenase 0.0441 0.1352 0.1352
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0121 0.0279 0.0815
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Echinococcus granulosus tyrosine kinase 0.0183 0.0489 0.1426
Schistosoma mansoni tyrosine kinase 0.0037 0.0000000055052 0.000000016052
Loa Loa (eye worm) hypothetical protein 0.0062 0.0083 0.0083
Mycobacterium tuberculosis Putative conserved ATPase 0.0086 0.0163 0.0228
Brugia malayi Wrapper/rega-1/klingon homolog protein 1 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0231 0.065 0.065
Echinococcus multilocularis Immunoglobulin 0.0121 0.0279 0.0815
Mycobacterium ulcerans hypothetical protein 0.0095 0.0195 0.0325
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0067 0.01 0.029
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0111 0.0246 0.0246
Echinococcus granulosus roundabout 2 0.0111 0.0246 0.0717
Echinococcus multilocularis Immunoglobulin subtype 0.0062 0.0083 0.0242
Brugia malayi chloride channel protein 7 0.0063 0.0086 0.0086
Brugia malayi Sex muscle abnormal protein 5 0.0037 0.0000081786 0.0000081786
Echinococcus multilocularis neuroglian 0.0111 0.0246 0.0717
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Mycobacterium ulcerans acyl-CoA synthetase 0.0095 0.0195 0.0325
Brugia malayi Immunoglobulin I-set domain containing protein 0.0067 0.01 0.01
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.0143 0.0356 0.0372
Loa Loa (eye worm) TK/KIN16 protein kinase 0.3021 1 1
Echinococcus granulosus twitchin 0.0169 0.0442 0.1289
Schistosoma mansoni tyrosine kinase 0.0056 0.0062 0.0179
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Onchocerca volvulus Tyrosine kinase homolog 0.2887 0.9551 1
Echinococcus granulosus Immunoglobulin subtype 0.0062 0.0083 0.0242
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus granulosus lachesin 0.0111 0.0246 0.0717
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Brugia malayi CLC chloride channel protein 0.0063 0.0086 0.0086
Echinococcus granulosus neuroglian 0.0111 0.0246 0.0717
Schistosoma mansoni neuroglian 0.0111 0.0246 0.0717
Echinococcus multilocularis cell adhesion molecule:down regulated by 0.0062 0.0083 0.0242
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0049 0.0038 0.0038
Schistosoma mansoni septate junction protein 0.0062 0.0083 0.0242
Schistosoma mansoni AMP-activated protein kinase gamma regulatory subunit 0.0063 0.0086 0.0252
Onchocerca volvulus 0.0049 0.0038 0.004
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0111 0.0246 0.0246
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.0111 0.0246 0.0717
Echinococcus multilocularis tyrosine protein kinase shark 0.0037 0.0000000055052 0.000000016052
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0111 0.0246 0.0246
Echinococcus multilocularis roundabout 2 0.0111 0.0246 0.0717
Loa Loa (eye worm) hypothetical protein 0.0095 0.0195 0.0195
Leishmania major inosine-5-monophosphate dehydrogenase 0.1061 0.343 1
Echinococcus multilocularis tyrosine protein kinase HCK 0.0164 0.0426 0.1242
Loa Loa (eye worm) SRC-1 0.0201 0.0551 0.0551
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) TK protein kinase 0.0067 0.01 0.01
Mycobacterium leprae PROBABLE INOSINE-5'-MONOPHOSPHATE DEHYDROGENASE GUAB1(IMP DEHYDROGENASE) (IMPDH) (IMPD) 0.0504 0.1563 0.4418
Loa Loa (eye worm) hypothetical protein 0.0062 0.0083 0.0083
Brugia malayi valosin containing protein 0.0084 0.0157 0.0157
Echinococcus multilocularis Opioid binding protein:cell adhesion molecule 0.0049 0.0038 0.0111
Loa Loa (eye worm) hypothetical protein 0.0095 0.0195 0.0195
Echinococcus granulosus H:Cl exchange transporter 4 0.0063 0.0086 0.0252
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0201 0.0551 0.1605
Schistosoma mansoni titin 0.0111 0.0246 0.0717
Brugia malayi inosine-5'-monophosphate dehydrogenase family protein 0.1061 0.343 0.343
Entamoeba histolytica cdc48-like protein, putative 0.0136 0.0331 0.7768
Trypanosoma brucei GMP reductase 0.1061 0.343 1
Loa Loa (eye worm) TK protein kinase 0.0164 0.0426 0.0426
Plasmodium vivax acyl-CoA synthetase, putative 0.0071 0.0114 0.0206
Echinococcus granulosus titin 0.0049 0.0038 0.0111
Echinococcus multilocularis Immunoglobulin 0.0062 0.0083 0.0242
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0183 0.0489 0.1426
Loa Loa (eye worm) hypothetical protein 0.0063 0.0086 0.0086
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0067 0.0101 0.0044
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0095 0.0195 0.0325
Onchocerca volvulus 0.0049 0.0038 0.004
Brugia malayi Fibronectin type III domain containing protein 0.0121 0.0279 0.0279
Loa Loa (eye worm) hypothetical protein 0.0062 0.0083 0.0083
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0083 0.0083
Brugia malayi ancient conserved domain protein 4 0.0063 0.0086 0.0086
Echinococcus granulosus titin 0.0049 0.0038 0.0111
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0121 0.0279 0.0815
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus granulosus roundabout 2 0.0111 0.0246 0.0717
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0062 0.0083 0.0242
Onchocerca volvulus 0.0049 0.0038 0.004
Echinococcus multilocularis neuroglian 0.0169 0.0442 0.1289
Echinococcus granulosus leucine rich repeat containing protein 4 0.0049 0.0038 0.0111
Plasmodium falciparum acyl-CoA synthetase 0.0071 0.0114 0.0089
Schistosoma mansoni basigin related 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Echinococcus multilocularis pro neuregulin 2, membrane bound 0.0062 0.0083 0.0242
Schistosoma mansoni AMP-activated protein kinase gamma regulatory subunit 0.0063 0.0086 0.0252
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0111 0.0246 0.0717
Leishmania major guanosine monophosphate reductase 0.1061 0.343 1
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Brugia malayi Prion-like- 0.0049 0.0038 0.0038
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0201 0.0551 0.1605
Echinococcus multilocularis hemicentin 1 0.0111 0.0246 0.0717
Loa Loa (eye worm) hypothetical protein 0.0071 0.0114 0.0114
Brugia malayi hypothetical protein 0.0261 0.0751 0.0751
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0261 0.0751 0.0751
Echinococcus granulosus titin 0.0049 0.0038 0.0111
Toxoplasma gondii IMP dehydrogenas 0.1061 0.343 1
Loa Loa (eye worm) projectin 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin domain containing protein 0.0062 0.0083 0.0083
Entamoeba histolytica protein kinase, putative 0.0164 0.0426 1
Brugia malayi Disorganized muscle protein 1 0.0049 0.0038 0.0038
Brugia malayi basement membrane proteoglycan precursor 0.0062 0.0083 0.0083
Treponema pallidum hemolysin (tlyC) 0.0063 0.0086 0.5
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.0136 0.0331 0.7768
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0201 0.0551 0.1605
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0201 0.0551 0.1605
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0071 0.0114 0.0114
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Echinococcus granulosus H:Cl exchange transporter 7 0.0063 0.0086 0.0252
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0083 0.0083
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0056 0.0062 0.0179
Schistosoma mansoni nephrin 0.0111 0.0246 0.0717
Schistosoma mansoni AMP-activated protein kinase gamma regulatory subunit 0.0063 0.0086 0.0252
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0183 0.0489 0.1426
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) IMP dehydrogenase 1 0.1061 0.343 0.343
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Echinococcus granulosus contactin 0.0111 0.0246 0.0717
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0095 0.0195 0.0325
Trypanosoma cruzi GMP reductase 0.1061 0.343 1
Loa Loa (eye worm) hypothetical protein 0.0063 0.0086 0.0086
Schistosoma mansoni peroxidasin 0.0062 0.0083 0.0242
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1061 0.343 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Schistosoma mansoni vesicular amine transporter 0.0124 0.029 0.0846
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Echinococcus multilocularis lachesin 0.0111 0.0246 0.0717
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0056 0.0062 0.0179
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0083 0.0083
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0201 0.0551 0.1605
Loa Loa (eye worm) chloride channel protein 7 0.0063 0.0086 0.0086
Schistosoma mansoni inosine-5-monophosphate dehydrogenase 0.1061 0.343 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0095 0.0195 0.0325
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0067 0.01 0.029
Onchocerca volvulus Peroxidasin homolog 0.0049 0.0038 0.004
Echinococcus multilocularis SNF4:AMP activated protein kinase gamma subunit 0.0063 0.0086 0.0252
Echinococcus multilocularis c src tyrosine kinase 0.0056 0.0062 0.0179
Echinococcus multilocularis peroxidasin 0.0111 0.0246 0.0717
Leishmania major 4-coumarate:coa ligase-like protein 0.0095 0.0195 0.0325
Brugia malayi Voltage gated chloride channel family protein 0.0063 0.0086 0.0086
Schistosoma mansoni septate junction protein 0.0111 0.0246 0.0717
Onchocerca volvulus 0.0049 0.0038 0.004
Loa Loa (eye worm) hypothetical protein 0.0063 0.0086 0.0086
Schistosoma mansoni cell adhesion molecule 0.0183 0.0487 0.1421
Brugia malayi Immunoglobulin domain containing protein 0.0062 0.0083 0.0083
Trypanosoma brucei inosine-5'-monophosphate dehydrogenase 0.1061 0.343 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0071 0.0114 0.0083
Loa Loa (eye worm) hypothetical protein 0.0063 0.0086 0.0086
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Mycobacterium ulcerans acyl-CoA synthetase 0.0095 0.0195 0.0325
Echinococcus granulosus tyrosine protein kinase HCK 0.0164 0.0426 0.1242
Onchocerca volvulus 0.0049 0.0038 0.004
Echinococcus multilocularis H(+):Cl() exchange transporter 7 0.0063 0.0086 0.0252
Loa Loa (eye worm) TK protein kinase 0.0183 0.0489 0.0489
Echinococcus multilocularis roundabout 2 0.0111 0.0246 0.0717
Echinococcus granulosus Opioid binding protein:cell adhesion molecule 0.0049 0.0038 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus granulosus tyrosine protein kinase Src64B 0.0201 0.0551 0.1605
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Mycobacterium ulcerans inosine 5-monophosphate dehydrogenase 0.0504 0.1563 0.4418
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0071 0.0114 1
Echinococcus multilocularis tyrosine protein kinase Abl 0.0056 0.0062 0.0179
Trypanosoma brucei Valosin-containing protein 0.0136 0.0331 0.0731
Schistosoma mansoni serine/threonine protein kinase 0.0049 0.0038 0.0111
Brugia malayi Leucine Rich Repeat family protein 0.0049 0.0038 0.0038
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0059 0.0074 0.0216
Echinococcus granulosus tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Echinococcus granulosus pro neuregulin 2 membrane bound 0.0062 0.0083 0.0242
Mycobacterium leprae Probable inosine-5'-monophosphate dehydrogenase GuaB2 (IMP dehydrogenase) (IMPDH) (IMPD) 0.1061 0.343 1
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Echinococcus granulosus nephrin 0.0049 0.0038 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Echinococcus granulosus neuroglian 0.0169 0.0442 0.1289
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Loa Loa (eye worm) LAD-2 short isoform 0.0062 0.0083 0.0083
Echinococcus multilocularis transfer RNA-Phe 0.0049 0.0038 0.0111
Echinococcus granulosus tyrosine protein kinase shark 0.0037 0.0000000055052 0.000000016052
Echinococcus multilocularis twitchin 0.0049 0.0038 0.0111
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0084 0.0157 0.0157
Mycobacterium leprae Probable inosine-5'-monophosphate dehydrogenase GuaB3 (IMP dehydrogenase 2) (inosinic acid dehydrogenase) (inosinate dehydrogena 0.0557 0.1742 0.4951
Brugia malayi Peroxidasin 0.0111 0.0246 0.0246
Brugia malayi Tyrosine-protein kinase abl-1 0.0056 0.0062 0.0062
Onchocerca volvulus Putative GMP reductase 0.0441 0.1352 0.1416
Echinococcus granulosus SNF4:AMP activated protein kinase gamma subunit 0.0063 0.0086 0.0252
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0062 0.0083 0.0242
Echinococcus granulosus AMP activated protein kinase gamma regulatory 0.0063 0.0086 0.0252
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Toxoplasma gondii cell division protein CDC48AP 0.0086 0.0163 0.0228
Echinococcus granulosus down syndrome cell adhesion 0.0049 0.0038 0.0111
Echinococcus multilocularis hemicentin 1 0.0111 0.0246 0.0717
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Trypanosoma cruzi Valosin-containing protein, putative 0.0136 0.0331 0.0731
Echinococcus multilocularis insulin growth factor binding 0.0049 0.0038 0.0111
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus multilocularis 0.0049 0.0038 0.0111
Echinococcus granulosus netrin receptor unc 5 0.0062 0.0083 0.0242
Brugia malayi Animal haem peroxidase family protein 0.0049 0.0038 0.0038
Brugia malayi Myb-like DNA-binding domain containing protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Loa Loa (eye worm) TK/ROR protein kinase 0.0067 0.01 0.01
Loa Loa (eye worm) hypothetical protein 0.0062 0.0083 0.0083
Brugia malayi AMP-binding enzyme family protein 0.0095 0.0195 0.0195
Mycobacterium tuberculosis Probable inosine-5'-monophosphate dehydrogenase GuaB2 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase 0.1061 0.343 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Schistosoma mansoni chloride channel protein 0.0063 0.0086 0.0252
Onchocerca volvulus Putative titin 0.0049 0.0038 0.004
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Schistosoma mansoni cell adhesion molecule 0.0111 0.0246 0.0717
Schistosoma mansoni hemicentin 0.0049 0.0038 0.0111
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0095 0.0195 0.0325
Echinococcus granulosus titin 0.0049 0.0038 0.0111
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0095 0.0195 0.0325
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0059 0.0074 0.0216
Echinococcus granulosus transitional endoplasmic reticulum atpase 0.0143 0.0356 0.1037
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0083 0.0083
Brugia malayi inosine-5'-monophosphate dehydrogenase 0.0441 0.1352 0.1352
Echinococcus granulosus tyrosine protein kinase Blk 0.0183 0.0489 0.1426
Brugia malayi AMP-binding enzyme family protein 0.0095 0.0195 0.0195
Echinococcus granulosus Immunoglobulin 0.0062 0.0083 0.0242
Treponema pallidum Mg2+ transport protein (mgtE) 0.0063 0.0086 0.5
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0201 0.0551 0.1605
Schistosoma mansoni myosin-binding protein-related 0.0049 0.0038 0.0111
Loa Loa (eye worm) one IG domain family member 0.0049 0.0038 0.0038
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1061 0.343 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus multilocularis titin 0.0049 0.0038 0.0111
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0071 0.0114 0.0083
Schistosoma mansoni cell adhesion molecule 0.0111 0.0246 0.0717
Onchocerca volvulus 0.0063 0.0086 0.0091
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Schistosoma mansoni cell adhesion molecule 0.0062 0.0083 0.0242
Leishmania major 4-coumarate:coa ligase-like protein 0.0095 0.0195 0.0325
Plasmodium falciparum inosine-5'-monophosphate dehydrogenase 0.0998 0.3219 1
Brugia malayi vesicle-fusing ATPase 0.0084 0.0157 0.0157
Schistosoma mansoni cell adhesion molecule 0.0049 0.0038 0.0111
Echinococcus multilocularis leucine rich repeats and immunoglobulin 0.0049 0.0038 0.0111
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Onchocerca volvulus 0.282 0.9327 0.9765
Echinococcus granulosus hemicentin 1 0.0111 0.0246 0.0717
Echinococcus multilocularis H(+):Cl() exchange transporter 4 0.0063 0.0086 0.0252
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Trypanosoma cruzi GMP reductase 0.1061 0.343 1
Echinococcus multilocularis roundabout 2 0.0231 0.065 0.1895
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.0136 0.0331 0.0731
Brugia malayi hypothetical protein 0.0062 0.0083 0.0083
Echinococcus granulosus tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Mycobacterium tuberculosis Probable inosine-5'-monophosphate dehydrogenase GuaB3 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase 0.0557 0.1742 0.4951
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0095 0.0195 0.0195
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0111 0.0246 0.0717
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0121 0.0279 0.0815
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Wolbachia endosymbiont of Brugia malayi IMP dehydrogenase 0.1061 0.343 1
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Schistosoma mansoni septate junction protein 0.0062 0.0083 0.0242
Schistosoma mansoni low-density lipoprotein receptor (ldl) 0.0062 0.0083 0.0242
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0136 0.0331 0.0965
Loa Loa (eye worm) VCP protein 0.0059 0.0074 0.0074
Echinococcus granulosus tyrosine protein kinase Src42A 0.0201 0.0551 0.1605
Leishmania major 4-coumarate:coa ligase-like protein 0.0095 0.0195 0.0325
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0095 0.0195 0.0325
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0201 0.0551 0.1605
Echinococcus granulosus insulin growth factor binding 0.0049 0.0038 0.0111
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0143 0.0356 0.1037
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Echinococcus multilocularis Immunoglobulin 0.0121 0.0279 0.0815
Schistosoma mansoni subfamily M23B non-peptidase homologue (M23 family) 0.0049 0.0038 0.0111
Echinococcus multilocularis Immunoglobulin 0.0062 0.0083 0.0242
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Toxoplasma gondii cell division protein CDC48CY 0.0143 0.0356 0.0805
Brugia malayi CBS domain containing protein 0.0063 0.0086 0.0086
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0111 0.0246 0.0717
Loa Loa (eye worm) disorganized muscle protein 1 0.0049 0.0038 0.0038
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0111 0.0246 0.0717
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0062 0.0083 0.0083
Schistosoma mansoni serine/threonine protein kinase 0.0049 0.0038 0.0111
Brugia malayi sulfakinin receptor protein 0.0261 0.0751 0.0751
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0037 0.0000081786 0.0000081786
Brugia malayi Prion-like- 0.0111 0.0246 0.0246
Schistosoma mansoni netrin receptor unc5 0.0062 0.0083 0.0242
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0111 0.0246 0.0717
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Echinococcus multilocularis netrin receptor unc 5 0.0062 0.0083 0.0242
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Schistosoma mansoni cell adhesion molecule 0.0111 0.0246 0.0717
Onchocerca volvulus 0.0049 0.0038 0.004
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Entamoeba histolytica acyl-CoA synthetase, putative 0.0095 0.0195 0.4584
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Onchocerca volvulus 0.0095 0.0195 0.0204
Brugia malayi AMP-binding enzyme family protein 0.0095 0.0195 0.0195
Echinococcus multilocularis low density lipoprotein receptor (ldl) 0.0062 0.0083 0.0242
Loa Loa (eye worm) CAMK protein kinase 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus granulosus pro neuregulin 2 membrane bound 0.0049 0.0038 0.0111
Onchocerca volvulus 0.0049 0.0038 0.004
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0095 0.0195 0.0325
Schistosoma mansoni nephrin related 0.0062 0.0083 0.0242
Brugia malayi Variant SH3 domain containing protein 0.0037 0.0000081786 0.0000081786
Echinococcus granulosus peroxidasin 0.0111 0.0246 0.0717
Brugia malayi Prion-like- 0.0049 0.0038 0.0038
Echinococcus multilocularis inosine 5' monophosphate dehydrogenase 2 0.1061 0.343 1
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0165 0.0428 0.1247
Echinococcus granulosus defective proboscis extension response 0.0121 0.0279 0.0815
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0111 0.0246 0.0717
Loa Loa (eye worm) chloride channel 3 0.0063 0.0086 0.0086
Echinococcus granulosus leucine rich repeats and immunoglobulin 0.0049 0.0038 0.0111
Schistosoma mansoni nephrin related 0.0049 0.0038 0.0111
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus granulosus inosine 5' monophosphate dehydrogenase 2 0.1061 0.343 1
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0143 0.0356 0.1037
Onchocerca volvulus Netrin receptor homolog 0.0049 0.0038 0.004
Brugia malayi ancient conserved domain protein 2 0.0063 0.0086 0.0086
Mycobacterium ulcerans inosine 5-monophosphate dehydrogenase 0.0998 0.3219 0.9369
Schistosoma mansoni roundabout 0.0111 0.0246 0.0717
Brugia malayi Immunoglobulin domain containing protein 0.0062 0.0083 0.0083
Schistosoma mansoni tyrosine kinase 0.0201 0.0551 0.1605
Brugia malayi SRC-1 0.0201 0.0551 0.0551
Brugia malayi hypothetical protein 0.0121 0.0279 0.0279
Echinococcus multilocularis pro neuregulin 2, membrane bound 0.0049 0.0038 0.0111
Schistosoma mansoni slit 0.0049 0.0038 0.0111
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0062 0.0083 0.0242
Plasmodium vivax inosine-5'-monophosphate dehydrogenase, putative 0.0998 0.3219 1
Brugia malayi protein unc-22 0.0049 0.0038 0.0038
Echinococcus granulosus Immunoglobulin 0.0062 0.0083 0.0242
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Echinococcus granulosus tyrosine protein kinase otk 0.0111 0.0246 0.0717
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Brugia malayi loechrig isoform VII 0.0063 0.0086 0.0086
Loa Loa (eye worm) hypothetical protein 0.0071 0.0114 0.0114
Echinococcus multilocularis down syndrome cell adhesion 0.0049 0.0038 0.0111
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Onchocerca volvulus Basement membrane proteoglycan homolog 0.0111 0.0246 0.0257
Onchocerca volvulus 0.0049 0.0038 0.004
Onchocerca volvulus 0.0049 0.0038 0.004
Loa Loa (eye worm) hypothetical protein 0.0111 0.0246 0.0246
Trichomonas vaginalis spermatogenesis associated factor, putative 0.0143 0.0356 0.5
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Schistosoma mansoni titin 0.0049 0.0038 0.0111
Schistosoma mansoni cell adhesion molecule 0.0049 0.0038 0.0111
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Echinococcus multilocularis tyrosine protein kinase Srms 0.0183 0.0489 0.1426
Loa Loa (eye worm) vesicle-fusing ATPase 0.0084 0.0157 0.0157
Loa Loa (eye worm) immunoglobulin domain-containing protein 0.0062 0.0083 0.0083
Schistosoma mansoni chloride channel protein 0.0063 0.0086 0.0252
Echinococcus multilocularis titin 0.0049 0.0038 0.0111
Loa Loa (eye worm) GMP reductase 0.0441 0.1352 0.1352
Onchocerca volvulus 0.0049 0.0038 0.004
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1061 0.343 1
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111
Loa Loa (eye worm) animal heme peroxidase 0.0049 0.0038 0.0038
Echinococcus multilocularis titin 0.0049 0.0038 0.0111
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0056 0.0062 0.0179
Onchocerca volvulus 0.0049 0.0038 0.004
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0111 0.0246 0.0717
Echinococcus granulosus c src tyrosine kinase 0.0056 0.0062 0.0179
Brugia malayi Immunoglobulin I-set domain containing protein 0.0049 0.0038 0.0038
Brugia malayi Immunoglobulin I-set domain containing protein 0.0121 0.0279 0.0279
Loa Loa (eye worm) hypothetical protein 0.0121 0.0279 0.0279
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0183 0.0487 0.1421
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Mycobacterium ulcerans ATPase 0.0086 0.0163 0.0228
Onchocerca volvulus Peroxidasin homolog 0.0049 0.0038 0.004
Brugia malayi Immunoglobulin I-set domain containing protein 0.0062 0.0083 0.0083
Echinococcus granulosus Immunoglobulin 0.0121 0.0279 0.0815
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0059 0.0074 0.0074
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0201 0.0551 0.1605
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.0246 0.0246
Echinococcus multilocularis 5' AMP activated protein kinase subunit gamma 0.0063 0.0086 0.0252
Schistosoma mansoni hypothetical protein 0.0062 0.0083 0.0242
Brugia malayi basement membrane proteoglycan 0.0062 0.0083 0.0083
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0201 0.0551 0.1605
Echinococcus granulosus basement membrane specific heparan sulfate 0.0062 0.0083 0.0242
Loa Loa (eye worm) hypothetical protein 0.0049 0.0038 0.0038
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0037 0.0000081786 0.0000081786
Schistosoma mansoni basigin related 0.0062 0.0083 0.0242
Brugia malayi Variant SH3 domain containing protein 0.0037 0.0000081786 0.0000081786
Entamoeba histolytica acyl-coA synthetase, putative 0.0095 0.0195 0.4584
Schistosoma mansoni protein kinase subunit gamma 0.0063 0.0086 0.0252
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0095 0.0195 0.0325
Schistosoma mansoni basigin related 0.0062 0.0083 0.0242
Schistosoma mansoni netrin receptor unc5 0.0062 0.0083 0.0242
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0049 0.0038 0.0038
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.0086 0.0163 0.0228
Echinococcus granulosus titin 0.0049 0.0038 0.0111
Echinococcus multilocularis H(+):Cl() exchange transporter 3 0.0063 0.0086 0.0252
Schistosoma mansoni hypothetical protein 0.0049 0.0038 0.0111

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.21 uM Concentration of compound that induced 50% of the maximal contraction in guinea pig gallbladder tissue when tested in vitro ChEMBL. No reference
EC50 (functional) = 0.21 uM Concentration of compound that induced 50% of the maximal contraction in guinea pig gallbladder tissue when tested in vitro ChEMBL. No reference
IC50 (binding) = -5.8 Tested for the 50% displacement of [125I]-CCK-8 from membrane preparation isolated from CHO-K1 cells stably transfected with the cDNA of human Cholecystokinin type A receptor ChEMBL. No reference
IC50 (binding) = -5 Tested for 50% displacement of [125I]-CCK-8 from membrane preparation isolated from CHO-K1 cells stably transfected with the cDNA of human Cholecystokinin type B receptor ChEMBL. No reference
Log IC50 (binding) = 5 Tested for 50% displacement of [125I]-CCK-8 from membrane preparation isolated from CHO-K1 cells stably transfected with the cDNA of human Cholecystokinin type B receptor ChEMBL. No reference
Log IC50 (binding) = 5.8 Tested for the 50% displacement of [125I]-CCK-8 from membrane preparation isolated from CHO-K1 cells stably transfected with the cDNA of human Cholecystokinin type A receptor ChEMBL. No reference
Relative efficacy (functional) = 0.6 Tested in vivo for the relative efficacy (relative to CCK-8 (1 nmol/kg)) for mouse gallbladder emptying after ip administration (0.1 umol/kg) ChEMBL. No reference
Relative efficacy (functional) = 0.6 Relative efficacy (1-30 uM) after incubation with CCK-8 (1 uM) tested in vitro ChEMBL. No reference
Relative efficacy (functional) = 0.6 Relative efficacy (1-30 uM) after incubation with CCK-8 (1 uM) tested in vitro ChEMBL. No reference
Relative efficacy (functional) = 0.6 Tested in vivo for the relative efficacy (relative to CCK-8 (1 nmol/kg)) for mouse gallbladder emptying after ip administration (0.1 umol/kg) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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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