Detailed information for compound 1055626

Basic information

Technical information
  • TDR Targets ID: 1055626
  • Name: 2-[3-(aminomethyl)phenyl]-N-[2-fluoro-4-(2-me thylsulfonylphenyl)phenyl]-5-(trifluoromethyl )pyrazole-3-carboxamide hydrochloride
  • MW: 568.971 | Formula: C25H21ClF4N4O3S
  • H donors: 2 H acceptors: 4 LogP: 4.6 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: NCc1cccc(c1)n1nc(cc1C(=O)Nc1ccc(cc1F)c1ccccc1S(=O)(=O)C)C(F)(F)F.Cl
  • InChi: 1S/C25H20F4N4O3S.ClH/c1-37(35,36)22-8-3-2-7-18(22)16-9-10-20(19(26)12-16)31-24(34)21-13-23(25(27,28)29)32-33(21)17-6-4-5-15(11-17)14-30;/h2-13H,14,30H2,1H3,(H,31,34);1H
  • InChiKey: LJBVKRYJJZQKGE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[3-(aminomethyl)phenyl]-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide hydrochloride
  • 2-[3-(aminomethyl)phenyl]-N-[2-fluoro-4-(2-mesylphenyl)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide hydrochloride
  • [3-[5-[[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylazanium chloride
  • [3-[5-[[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]phenyl]methylammonium chloride
  • [3-[5-[[[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]amino]-oxomethyl]-3-(trifluoromethyl)-1-pyrazolyl]phenyl]methylammonium chloride
  • [3-[5-[[2-fluoro-4-(2-mesylphenyl)phenyl]carbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]benzyl]ammonium chloride

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens coagulation factor X Starlite/ChEMBL References
Oryctolagus cuniculus Coagulation factor X Starlite/ChEMBL References
Homo sapiens plasminogen activator, urokinase Starlite/ChEMBL References
Homo sapiens protein C (inactivator of coagulation factors Va and VIIIa) Starlite/ChEMBL References
Homo sapiens coagulation factor II (thrombin) Starlite/ChEMBL References
Homo sapiens coagulation factor VII (serum prothrombin conversion accelerator) Starlite/ChEMBL References
Homo sapiens coagulation factor IX Starlite/ChEMBL References
Homo sapiens chymotrypsinogen B1 Starlite/ChEMBL References
Homo sapiens protease, serine, 1 (trypsin 1) References
Homo sapiens kallikrein B, plasma (Fletcher factor) 1 Starlite/ChEMBL References
Homo sapiens protease, serine, 3 Starlite/ChEMBL References
Homo sapiens protease, serine, 2 (trypsin 2) References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis enteropeptidase Get druggable targets OG5_136757 All targets in OG5_136757
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126639 All targets in OG5_126639
Toxoplasma gondii PAN domain-containing protein Get druggable targets OG5_134971 All targets in OG5_134971
Brugia malayi Trypsin family protein Get druggable targets OG5_126639 All targets in OG5_126639
Schistosoma japonicum ko:K01346 pancreatic elastase II [EC3.4.21.71], putative Get druggable targets OG5_136757 All targets in OG5_136757
Schistosoma japonicum ko:K09639 transmembrane protease, serine 8, putative Get druggable targets OG5_126639 All targets in OG5_126639
Onchocerca volvulus Get druggable targets OG5_126639 All targets in OG5_126639
Schistosoma japonicum ko:K09639 transmembrane protease, serine 8, putative Get druggable targets OG5_126639 All targets in OG5_126639
Onchocerca volvulus Get druggable targets OG5_126639 All targets in OG5_126639
Neospora caninum hypothetical protein Get druggable targets OG5_134971 All targets in OG5_134971
Echinococcus granulosus Mastin Get druggable targets OG5_136757 All targets in OG5_136757
Echinococcus granulosus enteropeptidase Get druggable targets OG5_136757 All targets in OG5_136757
Echinococcus multilocularis Mastin Get druggable targets OG5_136757 All targets in OG5_136757
Echinococcus multilocularis glycoprotein Antigen 5 Get druggable targets OG5_136757 All targets in OG5_136757
Neospora caninum hypothetical protein Get druggable targets OG5_134971 All targets in OG5_134971
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126639 All targets in OG5_126639
Echinococcus granulosus glycoprotein Antigen 5 Get druggable targets OG5_136757 All targets in OG5_136757
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) Get druggable targets OG5_126639 All targets in OG5_126639
Toxoplasma gondii PAN domain-containing protein Get druggable targets OG5_134971 All targets in OG5_134971
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) Get druggable targets OG5_136757 All targets in OG5_136757
Neospora caninum hypothetical protein Get druggable targets OG5_134971 All targets in OG5_134971
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) Get druggable targets OG5_126639 All targets in OG5_126639
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Trypsin family protein protease, serine, 1 (trypsin 1) 247 aa 287 aa 21.6 %
Schistosoma mansoni cercarial elastase (S01 family) protease, serine, 2 (trypsin 2) 247 aa 240 aa 25.8 %
Echinococcus granulosus glycoprotein Antigen 5 coagulation factor VII (serum prothrombin conversion accelerator) 466 aa 384 aa 23.7 %
Brugia malayi Trypsin family protein chymotrypsinogen B1 263 aa 261 aa 25.3 %
Echinococcus granulosus Mastin plasminogen activator, urokinase 414 aa 340 aa 24.4 %
Schistosoma mansoni cercarial elastase (S01 family) protease, serine, 3 261 aa 234 aa 25.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Trypsin-like protease protein 5 0.0058 0.0613 0.1169
Loa Loa (eye worm) hypothetical protein 0.0058 0.0613 0.1169
Loa Loa (eye worm) hypothetical protein 0.0049 0.0476 0.0907
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0256 0.0256
Echinococcus granulosus pyruvate kinase 0.0036 0.0289 0.0289
Plasmodium falciparum pyruvate kinase 0.007 0.0782 0.7931
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0044 0.0084
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0065 0.0706 0.1346
Echinococcus granulosus tar DNA binding protein 0.007 0.0783 0.0783
Echinococcus multilocularis glycoprotein Antigen 5 0.0104 0.1279 0.1279
Plasmodium vivax pyruvate kinase, putative 0.007 0.0782 0.7931
Onchocerca volvulus 0.0319 0.4402 0.836
Loa Loa (eye worm) hypothetical protein 0.0123 0.1559 0.2972
Loa Loa (eye worm) TK/ROR protein kinase 0.0057 0.0593 0.1131
Schistosoma mansoni hypothetical protein 0.0042 0.0378 0.0378
Onchocerca volvulus 0.0032 0.0239 0.0265
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Echinococcus multilocularis transmembrane protease serine 3 0.0058 0.0613 0.0613
Echinococcus granulosus Mastin 0.0104 0.1279 0.1279
Echinococcus multilocularis peptidase Clp (S14 family) 0.0054 0.056 0.056
Loa Loa (eye worm) hypothetical protein 0.0065 0.0706 0.1346
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0498 0.0949
Trichomonas vaginalis pyruvate kinase, putative 0.007 0.0782 0.2094
Onchocerca volvulus Pyruvate kinase homolog 0.007 0.0782 0.1322
Onchocerca volvulus 0.0057 0.0593 0.0954
Echinococcus multilocularis enteropeptidase 0.0104 0.1279 0.1279
Toxoplasma gondii 1,3(4)-beta-glucanase 0.0023 0.0102 0.0119
Trichomonas vaginalis CMGC family protein kinase 0.006 0.0647 0.1711
Trypanosoma cruzi pyruvate kinase 2, putative 0.007 0.0782 1
Schistosoma mansoni tar DNA-binding protein 0.007 0.0783 0.0783
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0029 0.0185 0.151
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0109 0.1348 0.1348
Echinococcus multilocularis pyruvate kinase 0.007 0.0782 0.0782
Echinococcus multilocularis cpg binding protein 0.003 0.021 0.021
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Echinococcus granulosus mitogen activated protein kinase 3 0.006 0.0647 0.0647
Toxoplasma gondii calcium binding egf domain-containing protein 0.0065 0.0706 0.1351
Trypanosoma cruzi hypothetical protein, conserved 0.0057 0.0593 0.7436
Onchocerca volvulus 0.0034 0.0256 0.0299
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.0378 0.0378
Echinococcus multilocularis pyruvate kinase 0.0036 0.0289 0.0289
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.0975 0.1901
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Toxoplasma gondii microneme protein MIC17A 0.0023 0.0102 0.0119
Loa Loa (eye worm) hypothetical protein 0.0034 0.0267 0.051
Echinococcus granulosus neural cadherin 0.0032 0.0239 0.0239
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.1174 0.1174
Toxoplasma gondii hypothetical protein 0.0023 0.0102 0.0119
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0498 0.0949
Echinococcus granulosus pyruvate kinase 0.007 0.0782 0.0782
Toxoplasma gondii pyruvate kinase PyKII 0.0036 0.0289 0.0501
Loa Loa (eye worm) pyruvate kinase 0.007 0.0782 0.1491
Entamoeba histolytica pyruvate kinase, putative 0.0049 0.0476 1
Echinococcus granulosus protein jagged 2 0.0032 0.0239 0.0239
Schistosoma mansoni hypothetical protein 0.0408 0.5697 0.5697
Leishmania major pyruvate kinase 0.007 0.0782 1
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0032 0.0239 0.0265
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0097 0.1174 0.2238
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0058 0.0613 0.0613
Brugia malayi hypothetical protein 0.0058 0.0613 0.1169
Schistosoma mansoni septate junction protein 0.0032 0.0239 0.0239
Onchocerca volvulus Neurogenic locus notch homolog 0.0032 0.0239 0.0265
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Loa Loa (eye worm) RNA binding protein 0.007 0.0783 0.1493
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0186 0.0354
Toxoplasma gondii microneme protein, putative 0.0023 0.0102 0.0119
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0109 0.1348 0.1348
Echinococcus multilocularis notch 0.0032 0.0239 0.0239
Schistosoma mansoni cpg binding protein 0.003 0.021 0.021
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Echinococcus granulosus neurogenic locus notch protein 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni hypothetical protein 0.0056 0.0585 0.0585
Trypanosoma cruzi pyruvate kinase 2, putative 0.007 0.0782 1
Trypanosoma brucei pyruvate kinase 1 0.007 0.0782 1
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0083 0.0975 0.0975
Echinococcus granulosus pyruvate kinase 0.0036 0.0289 0.0289
Echinococcus multilocularis pyruvate kinase 0.007 0.0782 0.0782
Echinococcus multilocularis protein jagged 1 0.0032 0.0239 0.0239
Toxoplasma gondii kringle domain-containing protein 0.0057 0.0593 0.1121
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Brugia malayi Pyruvate kinase, alpha/beta domain containing protein 0.0021 0.0076 0.0145
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0073 0.0822 0.0822
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Brugia malayi Delta serrate ligand family protein 0.0032 0.0239 0.0455
Echinococcus multilocularis Tolloid protein 1 0.0065 0.0706 0.0706
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0044 0.0084
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni cell polarity protein 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0065 0.0706 0.1346
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0083 0.0975 0.1901
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Echinococcus granulosus dnaJ subfamily B 0.0408 0.5697 0.5697
Toxoplasma gondii calcium binding egf domain-containing protein 0.0065 0.0706 0.1351
Trichomonas vaginalis CMGC family protein kinase 0.006 0.0647 0.1711
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.006 0.0647 0.8171
Onchocerca volvulus 0.0058 0.0613 0.0993
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Echinococcus granulosus peptidase Clp S14 family 0.0054 0.056 0.056
Echinococcus multilocularis survival motor neuron protein 1 0.0276 0.3769 0.3769
Toxoplasma gondii PAN/Apple domain-containing protein 0.0023 0.0102 0.0119
Trichomonas vaginalis CMGC family protein kinase 0.006 0.0647 0.1711
Toxoplasma gondii subtilisin SUB12 0.0023 0.0102 0.0119
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Onchocerca volvulus Pyruvate kinase homolog 0.007 0.0782 0.1322
Brugia malayi Cadherin domain containing protein 0.0032 0.0239 0.0455
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0073 0.0822 0.2207
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Onchocerca volvulus Huntingtin homolog 0.0123 0.1559 0.2832
Echinococcus multilocularis Mastin 0.0104 0.1279 0.1279
Giardia lamblia Pyruvate kinase 0.007 0.0782 1
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Echinococcus granulosus tissue type plasminogen activator 0.0057 0.0593 0.0593
Loa Loa (eye worm) TAR-binding protein 0.007 0.0783 0.1493
Echinococcus granulosus cpg binding protein 0.003 0.021 0.021
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.006 0.0647 0.8171
Trichomonas vaginalis set domain proteins, putative 0.0262 0.3569 1
Echinococcus granulosus neurogenic locus notch protein 0.0032 0.0239 0.0239
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.023 0.023
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0057 0.0593 0.5898
Trypanosoma brucei pyruvate kinase 1, putative 0.007 0.0782 1
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0576 0.1085
Schistosoma mansoni ap endonuclease 0.0019 0.0044 0.0044
Brugia malayi Calcium binding EGF domain containing protein 0.0032 0.0239 0.0455
Schistosoma mansoni hypothetical protein 0.0057 0.0593 0.0593
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.006 0.0647 0.8171
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Brugia malayi notch-like transmembrane receptor 0.0032 0.0239 0.0455
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Loa Loa (eye worm) PAN domain-containing protein 0.0023 0.0102 0.0195
Loa Loa (eye worm) hypothetical protein 0.0058 0.0613 0.1169
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0058 0.0613 0.0613
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.007 0.0783 0.1493
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0058 0.0613 0.0613
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0377 0.5245 0.5245
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Echinococcus granulosus neurogenic locus protein delta 0.0032 0.0239 0.0239
Echinococcus multilocularis neurogenic locus notch protein 0.0032 0.0239 0.0239
Brugia malayi RNA binding protein 0.007 0.0783 0.1493
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0058 0.0613 0.0613
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0097 0.1174 0.2238
Plasmodium vivax SET domain protein, putative 0.0034 0.0256 0.228
Trypanosoma brucei protein kinase, putative 0.006 0.0647 0.8171
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Echinococcus multilocularis fibrillin 1 0.0065 0.0706 0.0706
Loa Loa (eye worm) PAN domain-containing protein 0.0023 0.0102 0.0195
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0267 0.051
Echinococcus granulosus mitogen activated protein kinase 0.006 0.0647 0.0647
Echinococcus multilocularis neurogenic locus protein delta 0.0032 0.0239 0.0239
Schistosoma mansoni hypothetical protein 0.0705 1 1
Echinococcus granulosus pyruvate kinase 0.007 0.0782 0.0782
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Echinococcus granulosus delta-like protein 1 0.0032 0.0239 0.0239
Echinococcus granulosus Tolloid protein 1 0.0065 0.0706 0.0706
Brugia malayi Trypsin family protein 0.0377 0.5245 1
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Entamoeba histolytica hypothetical protein 0.0042 0.0378 0.7733
Onchocerca volvulus Putative cubilin 0.0032 0.0239 0.0265
Onchocerca volvulus 0.0032 0.0239 0.0265
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0029 0.0185 0.151
Loa Loa (eye worm) Notch2 0.0032 0.0239 0.0455
Onchocerca volvulus 0.0032 0.0239 0.0265
Toxoplasma gondii PAN domain-containing protein 0.0023 0.0102 0.0119
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0044 0.0044
Onchocerca volvulus 0.0058 0.0613 0.0993
Onchocerca volvulus 0.0032 0.0239 0.0265
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0498 0.0949
Schistosoma mansoni cpg binding protein 0.003 0.021 0.021
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.1174 0.1174
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0109 0.1348 0.1348
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0058 0.0613 0.0613
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni egf-like domain protein 0.0065 0.0706 0.0706
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.1174 0.1174
Echinococcus multilocularis tar DNA binding protein 0.007 0.0783 0.0783
Echinococcus multilocularis neurogenic locus notch protein 0.0032 0.0239 0.0239
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Toxoplasma gondii PAN domain-containing protein 0.0356 0.494 1
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0065 0.0706 0.1346
Echinococcus granulosus protein jagged 1 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0073 0.0822 0.1568
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0058 0.0613 0.0613
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni tar DNA-binding protein 0.007 0.0783 0.0783
Echinococcus multilocularis pyruvate kinase 0.0055 0.0569 0.0569
Entamoeba histolytica hypothetical protein 0.0042 0.0378 0.7733
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0276 0.3769 0.7185
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Brugia malayi Cadherin domain containing protein 0.0032 0.0239 0.0455
Onchocerca volvulus 0.0377 0.5245 1
Onchocerca volvulus 0.0056 0.0585 0.0939
Echinococcus granulosus neurogenic locus notch protein 4 0.0032 0.0239 0.0239
Echinococcus granulosus protein jagged 1 0.0032 0.0239 0.0239
Schistosoma mansoni cpg binding protein 0.0029 0.0186 0.0186
Toxoplasma gondii EGF family domain-containing protein 0.0032 0.0239 0.0397
Brugia malayi Pyruvate kinase, M2 isozyme 0.007 0.0782 0.1491
Echinococcus granulosus slit 2 protein 0.0032 0.0239 0.0239
Schistosoma mansoni serine/threonine protein kinase 0.006 0.0647 0.0647
Loa Loa (eye worm) hypothetical protein 0.0065 0.0706 0.1346
Plasmodium falciparum pyruvate kinase 2 0.0036 0.0289 0.2634
Onchocerca volvulus 0.0058 0.0613 0.0993
Toxoplasma gondii PAN domain-containing protein 0.0356 0.494 1
Echinococcus multilocularis slit 2 protein 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0123 0.1559 0.2972
Toxoplasma gondii microneme protein MIC17B 0.0023 0.0102 0.0119
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0058 0.0613 0.1169
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Brugia malayi hypothetical protein 0.0276 0.3769 0.7185
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0054 0.056 0.6982
Schistosoma mansoni tar DNA-binding protein 0.007 0.0783 0.0783
Toxoplasma gondii microneme protein MIC4 0.0023 0.0102 0.0119
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Schistosoma mansoni hypothetical protein 0.0034 0.0267 0.0267
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0256 0.0256
Echinococcus granulosus transmembrane protease serine 3 0.0058 0.0613 0.0613
Mycobacterium ulcerans pyruvate kinase 0.007 0.0782 0.7931
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.023 0.3109 0.5928
Brugia malayi RNA recognition motif domain containing protein 0.007 0.0783 0.1493
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0058 0.0613 0.0613
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0256 0.0256
Trichomonas vaginalis pyruvate kinase, putative 0.007 0.0782 0.2094
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0054 0.056 0.6982
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.067 0.067
Brugia malayi Trypsin family protein 0.0058 0.0613 0.1169
Leishmania major hypothetical protein, conserved 0.0057 0.0593 0.7436
Echinococcus multilocularis neural cadherin 0.0032 0.0239 0.0239
Brugia malayi Muscle positioning protein 4 0.0032 0.0239 0.0455
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0256 0.0256
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.006 0.0647 0.8171
Onchocerca volvulus 0.0262 0.3569 0.6741
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Brugia malayi GCC2 and GCC3 family protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) pyruvate kinase 0.007 0.0782 0.1491
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Echinococcus multilocularis geminin 0.0705 1 1
Brugia malayi Kringle domain containing protein 0.0057 0.0593 0.1131
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.0378 0.0378
Toxoplasma gondii PAN domain-containing protein 0.0023 0.0102 0.0119
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0256 0.0256
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.1174 0.1174
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0109 0.1348 0.1348
Brugia malayi Protein kinase domain containing protein 0.0057 0.0593 0.1131
Echinococcus granulosus survival motor neuron protein 1 0.0276 0.3769 0.3769
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0065 0.0706 0.0706
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0044 0.0044
Onchocerca volvulus Arrow homolog 0.0065 0.0706 0.1174
Brugia malayi hypothetical protein 0.0152 0.1977 0.3769
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.006 0.0647 0.1232
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.0378 0.0378
Loa Loa (eye worm) hypothetical protein 0.0065 0.0706 0.1346
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0097 0.1174 0.1174
Giardia lamblia Kinase, CMGC MAPK 0.006 0.0647 0.8171
Brugia malayi Pre-SET motif family protein 0.0034 0.0256 0.0489
Echinococcus multilocularis protein jagged 1 0.0032 0.0239 0.0239
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0097 0.1174 0.1174
Loa Loa (eye worm) PAN domain-containing protein 0.0023 0.0102 0.0195
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0058 0.0613 0.0613
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.006 0.0647 0.8171
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Brugia malayi Calcium binding EGF domain containing protein 0.0032 0.0239 0.0455
Toxoplasma gondii melibiase subfamily protein 0.0109 0.1348 0.2663
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.006 0.0647 0.8171
Entamoeba histolytica hypothetical protein 0.0042 0.0378 0.7733
Plasmodium falciparum cysteine repeat modular protein 1 0.0057 0.0593 0.5898
Schistosoma mansoni hypothetical protein 0.0058 0.0613 0.0613
Echinococcus multilocularis fat cadherin tumor suppressor 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0083 0.0975 0.1859
Entamoeba histolytica hypothetical protein 0.0042 0.0378 0.7733
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0083 0.0975 1
Loa Loa (eye worm) hypothetical protein 0.0065 0.0706 0.1346
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0256 0.0256
Loa Loa (eye worm) hypothetical protein 0.0377 0.5245 1
Toxoplasma gondii PAN domain-containing protein 0.0023 0.0102 0.0119
Giardia lamblia Pyruvate kinase 0.0036 0.0289 0.3321
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Schistosoma mansoni hypothetical protein 0.0705 1 1
Onchocerca volvulus 0.0029 0.0186 0.0162
Loa Loa (eye worm) PAN domain-containing protein 0.0023 0.0102 0.0195
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Brugia malayi Pre-SET motif family protein 0.023 0.3109 0.5928
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.006 0.0647 0.1234
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0097 0.1174 0.1174
Brugia malayi TAR-binding protein 0.007 0.0783 0.1493
Plasmodium vivax pyruvate kinase 2, putative 0.0036 0.0289 0.2634
Echinococcus multilocularis pyruvate kinase 0.0036 0.0289 0.0289
Brugia malayi Melibiase family protein 0.0073 0.0822 0.1568
Echinococcus multilocularis mitogen activated protein kinase 3 0.006 0.0647 0.0647
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0058 0.0613 0.0613
Echinococcus multilocularis dnaJ subfamily B 0.0408 0.5697 0.5697
Echinococcus granulosus laminin 0.0065 0.0706 0.0706
Mycobacterium ulcerans hypothetical protein 0.0058 0.0613 0.6112
Loa Loa (eye worm) hypothetical protein 0.0065 0.0706 0.1346
Echinococcus granulosus protein jagged 2 0.0032 0.0239 0.0239
Brugia malayi Trypsin family protein 0.0058 0.0613 0.1169
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.007 0.0782 0.1491
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0083 0.0975 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0256 0.0489
Echinococcus multilocularis laminin 0.0065 0.0706 0.0706
Echinococcus granulosus glycoprotein Antigen 5 0.0104 0.1279 0.1279
Schistosoma mansoni tar DNA-binding protein 0.007 0.0783 0.0783
Schistosoma mansoni ap endonuclease 0.0019 0.0044 0.0044
Brugia malayi hypothetical protein 0.0042 0.0378 0.0721
Brugia malayi CXXC zinc finger family protein 0.0029 0.0186 0.0354
Brugia malayi Fibulin-1 precursor 0.0065 0.0706 0.1346
Schistosoma mansoni survival motor neuron protein 0.0056 0.0585 0.0585
Brugia malayi Calcium binding EGF domain containing protein 0.0065 0.0706 0.1346
Brugia malayi hypothetical protein 0.0123 0.1559 0.2972
Schistosoma mansoni pyruvate kinase 0.007 0.0782 0.0782
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0065 0.0706 0.1346
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Brugia malayi Pyruvate kinase, muscle isozyme 0.007 0.0782 0.1491
Echinococcus granulosus notch 0.0032 0.0239 0.0239
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0032 0.0239 0.0455
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0083 0.0975 0.0975
Loa Loa (eye worm) pyruvate kinase 0.007 0.0782 0.1491
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0104 0.1279 0.1279
Brugia malayi EGF-like domain containing protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) hypothetical protein 0.0058 0.0613 0.1169
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0058 0.0613 0.1169
Loa Loa (eye worm) hypothetical protein 0.0152 0.1977 0.3769
Echinococcus granulosus enteropeptidase 0.0104 0.1279 0.1279
Onchocerca volvulus 0.0032 0.0239 0.0265
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0056 0.0585 0.1116
Loa Loa (eye worm) trypsin family protein 0.0058 0.0613 0.1169
Mycobacterium leprae Probable pyruvate kinase PykA 0.007 0.0782 0.7563
Brugia malayi Cytochrome P450 family protein 0.0052 0.0521 0.0994
Schistosoma mansoni notch 0.0032 0.0239 0.0239
Brugia malayi PAN domain containing protein 0.0023 0.0102 0.0195
Schistosoma mansoni laminin gamma-3 chain 0.0032 0.0239 0.0239
Echinococcus granulosus fibropellin Ia 0.0032 0.0239 0.0239
Onchocerca volvulus Pyruvate kinase homolog 0.007 0.0782 0.1322
Toxoplasma gondii PAN domain-containing protein 0.0023 0.0102 0.0119
Loa Loa (eye worm) hypothetical protein 0.0023 0.0102 0.0195
Brugia malayi Probable ClpP-like protease 0.0083 0.0975 0.1859
Onchocerca volvulus Slit protein homolog 0.0032 0.0239 0.0265
Trichomonas vaginalis CMGC family protein kinase 0.006 0.0647 0.1711
Schistosoma mansoni pyruvate kinase 0.0036 0.0289 0.0289
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Echinococcus multilocularis pyruvate kinase 0.0036 0.0289 0.0289
Echinococcus multilocularis protein jagged 2 0.0032 0.0239 0.0239
Loa Loa (eye worm) cytochrome P450 family protein 0.0052 0.0521 0.0994
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0256 0.0433
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0109 0.1348 0.1348
Onchocerca volvulus Huntingtin homolog 0.0123 0.1559 0.2832
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0029 0.0185 0.151
Echinococcus multilocularis neurogenic locus protein delta 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0058 0.0613 0.1169
Brugia malayi MAP kinase sur-1 0.006 0.0647 0.1234
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.006 0.0647 0.8171
Schistosoma mansoni hypothetical protein 0.0032 0.0239 0.0239
Onchocerca volvulus 0.0152 0.1977 0.3644
Echinococcus multilocularis mitogen activated protein kinase 0.006 0.0647 0.0647
Echinococcus granulosus pyruvate kinase 0.0036 0.0289 0.0289
Schistosoma mansoni hypothetical protein 0.0058 0.0613 0.0613
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.007 0.0782 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0256 0.0256
Brugia malayi Calcium binding EGF domain containing protein 0.0032 0.0239 0.0455
Loa Loa (eye worm) pyruvate kinase-PB 0.0049 0.0476 0.0907
Echinococcus multilocularis tissue type plasminogen activator 0.0057 0.0593 0.0593
Leishmania major pyruvate kinase 0.007 0.0782 1
Loa Loa (eye worm) hypothetical protein 0.005 0.0498 0.0949
Toxoplasma gondii hypothetical protein 0.0023 0.0102 0.0119
Toxoplasma gondii microneme protein MIC17C 0.0023 0.0102 0.0119
Schistosoma mansoni peptidase Clp (S14 family) 0.0083 0.0975 0.0975
Loa Loa (eye worm) notch protein 0.0032 0.0239 0.0455
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0377 0.5245 0.5245
Schistosoma mansoni pyruvate kinase 0.007 0.0782 0.0782
Onchocerca volvulus 0.0058 0.0613 0.0993
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0083 0.0975 1
Echinococcus multilocularis neurogenic locus notch protein 4 0.0032 0.0239 0.0239
Echinococcus multilocularis fibropellin Ia 0.0032 0.0239 0.0239
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0073 0.0822 0.0822
Onchocerca volvulus 0.0058 0.0613 0.0993
Toxoplasma gondii pyruvate kinase PyK1 0.007 0.0782 0.1507
Brugia malayi Trypsin family protein 0.0058 0.0613 0.1169
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0054 0.056 0.4744
Loa Loa (eye worm) hypothetical protein 0.0032 0.0239 0.0455
Schistosoma mansoni slit 0.0032 0.0239 0.0239
Loa Loa (eye worm) hypothetical protein 0.0377 0.5245 1
Toxoplasma gondii hypothetical protein 0.0029 0.0185 0.0287
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Loa Loa (eye worm) PAN domain-containing protein 0.0023 0.0102 0.0195
Schistosoma mansoni tar DNA-binding protein 0.007 0.0783 0.0783
Loa Loa (eye worm) hypothetical protein 0.0057 0.0593 0.1131
Giardia lamblia High cysteine protein 0.0032 0.0239 0.2632
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0109 0.1348 0.1348
Schistosoma mansoni cercarial elastase (S01 family) 0.0058 0.0613 0.0613
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0109 0.1348 0.1348

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 0.67 uM Anticoagulant activity in human plasma assessed as concentration required to double clotting time ChEMBL. 25523211
Activity (functional) = 0.7 uM Anticoagulant activity in mouse plasma assessed as concentration required to prolong prothombin time ChEMBL. 25523211
APTT (functional) = 4.86 uM In vitro activated partial thromboplastin time of the compound. ChEMBL. 11170646
IC2x (functional) = 1.7 uM Tested in vitro for rabbit activated partial thromboplastin time (APTT) by clotting assay ChEMBL. 14640539
IC2x (functional) = 4.86 uM human activated partial thromboplastin time (APTT) ChEMBL. 14640539
IC50 (binding) = 44000 nM In vitro activity against human Complement factor I ChEMBL. 11170646
IC50 (binding) = 0.0024 uM Inhibition of human factor 10a using S-2222 chromogenic substrate assessed as hydrolysis by microplate reader ChEMBL. 25523211
IC50 (binding) > 100 uM Inhibition of human Thrombin using S-2222 chromogenic substrate assessed as hydrolysis by microplate reader ChEMBL. 25523211
IC50 (binding) > 100 uM Inhibition of human Trypsin using S-2238 chromogenic substrate assessed as hydrolysis by microplate reader ChEMBL. 25523211
Ki (binding) = 0.15 nM Tested in vitro for inhibition of human Coagulation factor X ChEMBL. 14640539
Ki (binding) = 0.15 nM Binding affinity to human f10a ChEMBL. 16682200
Ki (binding) = 0.3 nM In vitro activity against rabbit factor Xa ChEMBL. 11170646
Ki (binding) = 0.3 nM Tested in vitro for inhibition of rabbit Coagulation factor X ChEMBL. 14640539
Ki (binding) = 60 nM In vitro activity against human trypsin. ChEMBL. 11170646
Ki (binding) = 60 nM Tested in vitro for inhibition of human trypsin ChEMBL. 14640539
Ki (binding) = 61 nM In vitro activity against human Plasma kallikrein. ChEMBL. 11170646
Ki (binding) = 61 nM Tested in vitro for inhibition of human plasma Kallikriene ChEMBL. 14640539
Ki (binding) = 1800 nM In vitro activity against human Activated protein C ChEMBL. 11170646
Ki (binding) = 1800 nM Tested in vitro for inhibition of human activated protein C ChEMBL. 14640539
Ki (binding) = 2200 nM In vitro activity against human factor IXa ChEMBL. 11170646
Ki (binding) = 2200 nM Tested in vitro for inhibition of human Coagulation factor IX ChEMBL. 14640539
Ki (binding) = 6000 nM In vitro activity against human thrombin. ChEMBL. 11170646
Ki (binding) = 6000 nM In vitro for inhibition of human thrombin ChEMBL. 14640539
Ki (binding) > 15000 nM The compound was tested for inhibition of human coagulation factor VII ChEMBL. 11170646
Ki (binding) > 15000 nM Tested in vitro for inhibition of human Coagulation factor VII ChEMBL. 14640539
Ki (binding) > 17000 nM In vitro activity against human Chymotrypsinogen B1 ChEMBL. 11170646
Ki (binding) > 17000 nM Tested in vitro for inhibition of human Chymotrypsinogen ChEMBL. 14640539
Ki (binding) > 19000 nM In vitro activity against human urokinase ChEMBL. 11170646
Ki (binding) > 19000 nM Tested in vitro for inhibition of human Urokinase-type plasminogen activator ChEMBL. 14640539
Ki (binding) > 35000 nM In vitro activity against human plasmin ChEMBL. 11170646
Ki (binding) > 35000 nM Tested in vitro for inhibition of human plasmin ChEMBL. 14640539
Ki (binding) > 45000 nM In vitro activity against human tissue plasminogen activator ChEMBL. 11170646
Ki (binding) > 45000 nM Tested in vitro for inhibition of human Tissue type plasminogen activator ChEMBL. 14640539
Ki (binding) = 0.15 uM Binding affinity against human coagulation factor X ChEMBL. 11170646
Papp (ADMET) = 0.00000486 cm s-1 Caco-2 permeability coefficient. ChEMBL. 11170646

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

4 literature references were collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.