Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50442377' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Transient receptor potential cation channel subfamily V member 1
(Homo sapiens (Human)) | BDBM50442377
(CHEMBL2442916)Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1 |(23.62,-43.51,;23.62,-45.06,;22.29,-45.83,;20.95,-45.06,;22.29,-47.37,;20.95,-48.14,;19.61,-47.37,;19.61,-45.83,;18.28,-45.06,;16.95,-45.83,;16.95,-47.37,;18.28,-48.14,;18.28,-49.69,;16.95,-50.46,;15.62,-49.68,;14.3,-50.45,;14.29,-51.98,;12.95,-52.75,;15.62,-52.76,;16.96,-51.99,;15.6,-45.06,;15.6,-43.52,;14.27,-45.83,;14.27,-44.28,;24.96,-45.83,;24.96,-47.37,;26.29,-48.14,;27.64,-47.37,;28.96,-48.14,;28.97,-49.68,;27.64,-50.46,;29.74,-51.01,;30.51,-49.68,;27.64,-45.83,;28.97,-45.06,;26.29,-45.06,)| Show InChI InChI=1S/C24H29F4N3O3S2/c1-14-4-8-18(9-5-14)35-23-17(7-11-21(30-23)24(26,27)28)13-29-22(32)15(2)16-6-10-20(19(25)12-16)31-36(3,33)34/h6-7,10-12,14-15,18,31H,4-5,8-9,13H2,1-3H3,(H,29,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of capsaicin-induced activity by FLIPR assay |
Bioorg Med Chem 21: 6657-64 (2013)
Article DOI: 10.1016/j.bmc.2013.08.015
BindingDB Entry DOI: 10.7270/Q26Q1ZPN |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily V member 1
(Homo sapiens (Human)) | BDBM50442377
(CHEMBL2442916)Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCC(C)CC1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1 |(23.62,-43.51,;23.62,-45.06,;22.29,-45.83,;20.95,-45.06,;22.29,-47.37,;20.95,-48.14,;19.61,-47.37,;19.61,-45.83,;18.28,-45.06,;16.95,-45.83,;16.95,-47.37,;18.28,-48.14,;18.28,-49.69,;16.95,-50.46,;15.62,-49.68,;14.3,-50.45,;14.29,-51.98,;12.95,-52.75,;15.62,-52.76,;16.96,-51.99,;15.6,-45.06,;15.6,-43.52,;14.27,-45.83,;14.27,-44.28,;24.96,-45.83,;24.96,-47.37,;26.29,-48.14,;27.64,-47.37,;28.96,-48.14,;28.97,-49.68,;27.64,-50.46,;29.74,-51.01,;30.51,-49.68,;27.64,-45.83,;28.97,-45.06,;26.29,-45.06,)| Show InChI InChI=1S/C24H29F4N3O3S2/c1-14-4-8-18(9-5-14)35-23-17(7-11-21(30-23)24(26,27)28)13-29-22(32)15(2)16-6-10-20(19(25)12-16)31-36(3,33)34/h6-7,10-12,14-15,18,31H,4-5,8-9,13H2,1-3H3,(H,29,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Seoul National University
Curated by ChEMBL
| Assay Description
Antagonist activity at human TRPV1 expressed in CHOK1 cells assessed as inhibition of pH-induced activity by FLIPR assay |
Bioorg Med Chem 21: 6657-64 (2013)
Article DOI: 10.1016/j.bmc.2013.08.015
BindingDB Entry DOI: 10.7270/Q26Q1ZPN |
More data for this
Ligand-Target Pair | |
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