Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50442374' 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)) | BDBM50442374
(CHEMBL2442919)Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCC(CC1)C(C)(C)C)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1 |(32.42,-1.77,;32.42,-3.31,;31.09,-4.08,;29.75,-3.31,;31.09,-5.63,;29.75,-6.4,;28.41,-5.63,;28.41,-4.08,;27.08,-3.31,;25.74,-4.08,;25.74,-5.63,;27.08,-6.4,;27.08,-7.94,;25.75,-8.71,;24.42,-7.94,;23.09,-8.7,;23.09,-10.24,;24.42,-11.01,;25.76,-10.25,;21.75,-11,;20.42,-10.23,;21.75,-12.54,;20.41,-11.76,;24.4,-3.31,;24.4,-1.78,;23.07,-4.09,;23.07,-2.54,;33.76,-4.08,;33.76,-5.63,;35.09,-6.4,;36.43,-5.63,;37.76,-6.4,;37.77,-7.94,;36.44,-8.71,;38.54,-9.27,;39.3,-7.93,;36.43,-4.08,;37.77,-3.31,;35.09,-3.31,)| Show InChI InChI=1S/C27H35F4N3O3S2/c1-16(17-6-12-22(21(28)14-17)34-39(5,36)37)24(35)32-15-18-7-13-23(27(29,30)31)33-25(18)38-20-10-8-19(9-11-20)26(2,3)4/h6-7,12-14,16,19-20,34H,8-11,15H2,1-5H3,(H,32,35) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.60 | 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)) | BDBM50442374
(CHEMBL2442919)Show SMILES CC(C(=O)NCc1ccc(nc1SC1CCC(CC1)C(C)(C)C)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1 |(32.42,-1.77,;32.42,-3.31,;31.09,-4.08,;29.75,-3.31,;31.09,-5.63,;29.75,-6.4,;28.41,-5.63,;28.41,-4.08,;27.08,-3.31,;25.74,-4.08,;25.74,-5.63,;27.08,-6.4,;27.08,-7.94,;25.75,-8.71,;24.42,-7.94,;23.09,-8.7,;23.09,-10.24,;24.42,-11.01,;25.76,-10.25,;21.75,-11,;20.42,-10.23,;21.75,-12.54,;20.41,-11.76,;24.4,-3.31,;24.4,-1.78,;23.07,-4.09,;23.07,-2.54,;33.76,-4.08,;33.76,-5.63,;35.09,-6.4,;36.43,-5.63,;37.76,-6.4,;37.77,-7.94,;36.44,-8.71,;38.54,-9.27,;39.3,-7.93,;36.43,-4.08,;37.77,-3.31,;35.09,-3.31,)| Show InChI InChI=1S/C27H35F4N3O3S2/c1-16(17-6-12-22(21(28)14-17)34-39(5,36)37)24(35)32-15-18-7-13-23(27(29,30)31)33-25(18)38-20-10-8-19(9-11-20)26(2,3)4/h6-7,12-14,16,19-20,34H,8-11,15H2,1-5H3,(H,32,35) | 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 | 90 | 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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