Detailed information for compound 435833

Basic information

Technical information
  • TDR Targets ID: 435833
  • Name: 3-chloro-N-[4-chloro-2-[(4-chlorophenyl)carba moyl]phenyl]-4-(pyrazol-1-ylmethyl)thiophene- 2-carboxamide
  • MW: 505.804 | Formula: C22H15Cl3N4O2S
  • H donors: 2 H acceptors: 3 LogP: 5.95 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1ccc(c(c1)C(=O)Nc1ccc(cc1)Cl)NC(=O)c1scc(c1Cl)Cn1cccn1
  • InChi: 1S/C22H15Cl3N4O2S/c23-14-2-5-16(6-3-14)27-21(30)17-10-15(24)4-7-18(17)28-22(31)20-19(25)13(12-32-20)11-29-9-1-8-26-29/h1-10,12H,11H2,(H,27,30)(H,28,31)
  • InChiKey: NYUCYTUIRJYMRW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 3-chloro-N-[4-chloro-2-[(4-chloroanilino)-oxomethyl]phenyl]-4-(1-pyrazolylmethyl)-2-thiophenecarboxamide
  • 3-chloro-N-[4-chloro-2-[[(4-chlorophenyl)amino]-oxomethyl]phenyl]-4-(1-pyrazolylmethyl)-2-thiophenecarboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens coagulation factor II (thrombin) Starlite/ChEMBL References
Homo sapiens coagulation factor X Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Brugia malayi Major Facilitator Superfamily protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0187 0.0767 0.0767
Loa Loa (eye worm) calpain 5 0.002 0.0029 0.0029
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0081 0.0076
Trypanosoma brucei calpain-like protein, putative 0.002 0.0029 0.008
Onchocerca volvulus Putative transporter 0.0014 0.0005 0.0005
Brugia malayi Sugar transporter family protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Brugia malayi calpain 7 0.002 0.0029 0.0029
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0014 0.0014
Brugia malayi calpain 5 0.002 0.0029 0.0029
Onchocerca volvulus 0.0014 0.0005 0.0005
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.2274 1 1
Echinococcus granulosus General substrate transporter 0.0087 0.0328 0.2
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Echinococcus multilocularis laminin 0.0016 0.0013 0.005
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0021 0.0036 0.0796
Echinococcus multilocularis calpain 0.002 0.0029 0.015
Echinococcus multilocularis calpain family protein 1, d 0.0047 0.0148 0.0887
Schistosoma mansoni hypothetical protein 0.0089 0.0337 0.4949
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Onchocerca volvulus 0.0014 0.0005 0.0005
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Entamoeba histolytica protein tyrosine phosphatase, putative 0.2274 1 1
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Trypanosoma brucei calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Plasmodium vivax hexose transporter 0.0102 0.0392 1
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Onchocerca volvulus 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Echinococcus granulosus laminin 0.0016 0.0013 0.005
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0014 0.0054
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0081 0.0076
Trichomonas vaginalis conserved hypothetical protein 0.0102 0.0392 0.0387
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0151 0.2175
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Loa Loa (eye worm) major facilitator superfamily transporter 0.0014 0.0005 0.0005
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0151 0.0901
Trypanosoma brucei glucose transporter 2A 0.0032 0.0081 0.0251
Trypanosoma cruzi calpain cysteine peptidase, putative 0.002 0.0029 0.008
Toxoplasma gondii calcium binding egf domain-containing protein 0.0016 0.0013 0.0208
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Echinococcus multilocularis fibrillin 1 0.0016 0.0013 0.005
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0016 0.0013 0.0013
Brugia malayi calpain family protein 1 0.0067 0.0236 0.0236
Echinococcus multilocularis hypothetical protein 0.002 0.0029 0.015
Echinococcus granulosus voltage dependent calcium channel subunit 0.038 0.1623 1
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Schistosoma mansoni calpain (C02 family) 0.002 0.0029 0.0363
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0019 0.0028 0.0023
Trypanosoma cruzi hexose transporter, putative 0.0017 0.0018 0.0043
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0081 0.0251
Brugia malayi Major Facilitator Superfamily protein 0.0014 0.0005 0.0005
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0014 0.0054
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0014 0.0014
Plasmodium falciparum cysteine repeat modular protein 1 0.0021 0.0036 0.0796
Onchocerca volvulus Arrow homolog 0.0016 0.0013 0.0013
Plasmodium falciparum hexose transporter 0.0102 0.0392 1
Schistosoma mansoni hypothetical protein 0.0016 0.0014 0.0131
Brugia malayi hypothetical protein 0.0014 0.0005 0.0005
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Echinococcus multilocularis voltage dependent calcium channel subunit 0.038 0.1623 1
Toxoplasma gondii facilitative glucose transporter GT1 0.0102 0.0392 1
Toxoplasma gondii calcium binding egf domain-containing protein 0.0016 0.0013 0.0208
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0081 0.0076
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0019 0.0028 0.5
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.2274 1 1
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0701 0.3042 1
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Leishmania major glucose transporter/membrane transporter D2, putative 0.0032 0.0081 0.0251
Loa Loa (eye worm) calpain family protein 1 0.0047 0.0148 0.0148
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Leishmania major glucose transporter, lmgt1 0.0032 0.0081 0.0251
Onchocerca volvulus 0.0014 0.0005 0.0005
Entamoeba histolytica protein tyrosine phosphatase, putative 0.2274 1 1
Leishmania major hypothetical protein, conserved 0.0701 0.3042 1
Onchocerca volvulus 0.0014 0.0005 0.0005
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0019 0.0028 0.0033
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Onchocerca volvulus 0.0014 0.0005 0.0005
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0151 0.2175
Brugia malayi major facilitator superfamily protein 0.0014 0.0005 0.0005
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.2274 1 1
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0084 0.0311 0.4573
Schistosoma mansoni egf-like domain protein 0.0016 0.0013 0.012
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0151 0.0901
Trichomonas vaginalis glucose transporter, putative 0.0032 0.0081 0.0076
Trypanosoma cruzi hypothetical protein, conserved 0.0021 0.0036 0.0101
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Brugia malayi calpain family protein 1 0.0067 0.0236 0.0236
Trypanosoma brucei kinesin, putative 0.002 0.0029 0.008
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0014 0.0014
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.007 0.0251 0.3673
Echinococcus granulosus family C2 unassigned peptidase C02 family 0.007 0.0251 0.1521
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0081 0.0251
Trypanosoma cruzi hypothetical protein, conserved 0.0701 0.3042 1
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0027 0.0061 0.0349
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0081 0.0076
Schistosoma mansoni serine-rich repeat protein 0.0089 0.0337 0.4949
Brugia malayi hypothetical protein 0.0014 0.0005 0.0005
Trypanosoma brucei antigen, putative 0.002 0.0029 0.008
Trypanosoma cruzi hypothetical protein, conserved 0.0701 0.3042 1
Onchocerca volvulus 0.0014 0.0005 0.0005
Echinococcus multilocularis General substrate transporter 0.0087 0.0328 0.2
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Loa Loa (eye worm) hypothetical protein 0.0067 0.0236 0.0236
Schistosoma mansoni glucose transport protein 0.0102 0.0392 0.5773
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0014 0.0054
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.2274 1 1
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0081 0.0251
Trypanosoma brucei THT1 - hexose transporter, putative 0.0032 0.0081 0.0251
Onchocerca volvulus 0.0014 0.0005 0.0005
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0016 0.0013 0.012
Onchocerca volvulus 0.0014 0.0005 0.0005
Schistosoma mansoni hypothetical protein 0.0016 0.0014 0.0131
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0081 0.0251
Loa Loa (eye worm) calpain family protein 1 0.0067 0.0236 0.0236
Loa Loa (eye worm) hypothetical protein 0.0021 0.0036 0.0036
Leishmania major glucose transporter, lmgt2 0.0032 0.0081 0.0251
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.2274 1 1
Onchocerca volvulus 0.0014 0.0005 0.0005
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.0169 0.0169
Schistosoma mansoni hypothetical protein 0.0102 0.0392 0.5773
Echinococcus granulosus nmda type glutamate receptor 0.0027 0.0061 0.0349
Echinococcus granulosus calpain A 0.007 0.0251 0.1521
Leishmania major calpain, putative,cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.2274 1 1
Trypanosoma cruzi kinesin, putative 0.002 0.0029 0.008
Onchocerca volvulus 0.0021 0.0036 0.0036
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.2274 1 1
Onchocerca volvulus 0.0014 0.0005 0.0005
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.2274 1 1
Onchocerca volvulus 0.0014 0.0005 0.0005
Brugia malayi major facilitator superfamily protein 0.0014 0.0005 0.0005
Leishmania major kinesin, putative 0.002 0.0029 0.008
Echinococcus multilocularis Tolloid protein 1 0.0016 0.0013 0.005
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0102 0.0392 0.2391
Loa Loa (eye worm) hypothetical protein 0.0067 0.0236 0.0236
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0701 0.3042 0.3039
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0081 0.0076
Trypanosoma brucei glucose transporter 1E 0.0032 0.0081 0.0251
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0187 0.0767 0.0767
Schistosoma mansoni hypothetical protein 0.0016 0.0014 0.0131
Loa Loa (eye worm) hypothetical protein 0.0052 0.0169 0.0169
Trypanosoma brucei calpain-like protein, putative 0.002 0.0029 0.008
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0019 0.0028 0.5
Echinococcus granulosus voltage dependent calcium channel subunit 0.0173 0.0706 0.4335
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0014 0.0054
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Schistosoma mansoni dihydropyridine-sensitive l-type calcium channel 0.0166 0.0675 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0151 0.0901
Echinococcus multilocularis voltage dependent calcium channel subunit 0.0173 0.0706 0.4335
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.0169 0.0169
Schistosoma mansoni Mername-AA248 (C02 family) 0.002 0.0029 0.0363
Leishmania major calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Loa Loa (eye worm) hypothetical protein 0.0047 0.0148 0.0148
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Brugia malayi Fibulin-1 precursor 0.0016 0.0013 0.0013
Echinococcus multilocularis calpain 5 0.002 0.0029 0.015
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0701 0.3042 0.3039
Onchocerca volvulus 0.0014 0.0005 0.0005
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0016 0.0013 0.0013
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.0169 0.0169
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Brugia malayi hypothetical protein 0.0014 0.0005 0.0005
Trypanosoma brucei glucose transporter, putative 0.0032 0.0081 0.0251
Echinococcus multilocularis calpain 7 (C02 family) 0.002 0.0029 0.015
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0016 0.0013 0.0013
Schistosoma mansoni calpain C (C02 family) 0.002 0.0029 0.0363
Plasmodium vivax calpain, putative 0.002 0.0029 0.0628
Brugia malayi Sugar transporter family protein 0.0102 0.0392 0.0392
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) sugar transporter 0.0102 0.0392 0.0392
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.007 0.0251 0.3673
Echinococcus granulosus calpain 7 C02 family 0.002 0.0029 0.015
Loa Loa (eye worm) hypothetical protein 0.0077 0.028 0.028
Echinococcus granulosus Tolloid protein 1 0.0016 0.0013 0.005
Echinococcus multilocularis tissue type plasminogen activator 0.0021 0.0036 0.019
Brugia malayi Sugar transporter family protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0035 0.0097 0.0097
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0097 0.0097
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0019 0.0028 0.5
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Schistosoma mansoni hypothetical protein 0.0035 0.0097 0.1379
Loa Loa (eye worm) calpain 0.002 0.0029 0.0029
Brugia malayi Cache domain containing protein 0.0077 0.028 0.028
Toxoplasma gondii kringle domain-containing protein 0.0021 0.0036 0.0796
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0151 0.2175
Loa Loa (eye worm) hypothetical protein 0.0047 0.0148 0.0148
Onchocerca volvulus 0.2274 1 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Echinococcus multilocularis family C2 unassigned peptidase (C02 family) 0.007 0.0251 0.1521
Echinococcus granulosus tissue type plasminogen activator 0.0021 0.0036 0.019
Onchocerca volvulus 0.0047 0.0148 0.0148
Brugia malayi N-terminal motif family protein 0.0187 0.0767 0.0767
Leishmania major hypothetical protein, conserved 0.0021 0.0036 0.0101
Onchocerca volvulus 0.0014 0.0005 0.0005
Brugia malayi Kringle domain containing protein 0.0021 0.0036 0.0036
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0102 0.0392 0.2391
Trichomonas vaginalis sugar transporter, putative 0.0032 0.0081 0.0076
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0151 0.0901
Schistosoma mansoni hypothetical protein 0.0021 0.0036 0.046
Echinococcus multilocularis nmda type glutamate receptor 0.0027 0.0061 0.0349
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0016 0.0014 0.0014
Trypanosoma cruzi hexose transporter 0.0032 0.0081 0.0251
Trypanosoma brucei calpain-like protein, putative 0.002 0.0029 0.008
Loa Loa (eye worm) hypothetical protein 0.0014 0.0005 0.0005
Schistosoma mansoni hypothetical protein 0.0016 0.0014 0.0131
Loa Loa (eye worm) major facilitator superfamily transporter 0.0014 0.0005 0.0005
Trypanosoma brucei cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0151 0.0151
Loa Loa (eye worm) hypothetical protein 0.0016 0.0013 0.0013
Echinococcus multilocularis GPCR, family 2 0.0016 0.0014 0.0054
Schistosoma mansoni calpain-7 (C02 family) 0.002 0.0029 0.0363
Onchocerca volvulus 0.0014 0.0005 0.0005
Onchocerca volvulus 0.0014 0.0005 0.0005
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0016 0.0013 0.0013
Loa Loa (eye worm) sugar transporter 0.0014 0.0005 0.0005
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.1573 0.6899 1
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Schistosoma mansoni glucose transport protein 0.0102 0.0392 0.5773
Schistosoma mansoni calpain-7 (C02 family) 0.002 0.0029 0.0363
Echinococcus granulosus calpain A 0.002 0.0029 0.015
Brugia malayi Major Facilitator Superfamily protein 0.0014 0.0005 0.0005
Echinococcus granulosus GPCR family 2 0.0016 0.0014 0.0054
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0014 0.0005 0.5
Brugia malayi Protein kinase domain containing protein 0.0021 0.0036 0.0036
Chlamydia trachomatis glutamine binding protein 0.0019 0.0028 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0151 0.0151
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.2274 1 1
Leishmania major glucose transporter, lmgt3 0.0032 0.0081 0.0251
Brugia malayi Calcium binding EGF domain containing protein 0.0016 0.0013 0.0013
Echinococcus granulosus calpain 0.002 0.0029 0.015
Loa Loa (eye worm) TK/ROR protein kinase 0.0021 0.0036 0.0036
Echinococcus granulosus calpain 5 0.002 0.0029 0.015
Trypanosoma cruzi calpain-like cysteine peptidase, putative 0.002 0.0029 0.008
Trypanosoma cruzi cysteine peptidase, Clan CA, family C2, putative 0.002 0.0029 0.008
Schistosoma mansoni glucose transport protein 0.0102 0.0392 0.5773
Trypanosoma cruzi kinesin, putative 0.002 0.0029 0.008
Trypanosoma brucei calpain-like protein, putative 0.002 0.0029 0.008
Echinococcus multilocularis calpain A 0.007 0.0251 0.1521
Trypanosoma cruzi hexose transporter, putative 0.0032 0.0081 0.0251
Schistosoma mansoni family C2 unassigned peptidase (C02 family) 0.0067 0.0236 0.3448

Activities

Activity type Activity value Assay description Source Reference
Cp (functional) = 49 uM Anticoagulant activity in human plasma assessed as concentration required to double prothrombin time ChEMBL. 17227710
Ki (binding) = 2.1 nM Binding affinity to human factor 10a after 10 mins ChEMBL. 17227710
Ki (binding) = 550 nM Binding affinity to human thrombin after 10 mins ChEMBL. 17227710
Ki app (binding) = 2.1 nM Binding affinity to human factor 10a after 10 mins ChEMBL. 17227710
Ki app (binding) = 550 nM Binding affinity to human thrombin after 10 mins ChEMBL. 17227710
Ki app (binding) > 5000 nM Binding affinity to bovine trypsin after 10 mins ChEMBL. 17227710

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

1 literature reference was collected for this gene.

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