Found 3 hits of Enzyme Inhibition Constant Data 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)) | BDBM50052442
((4-Hydroxy-3-methoxy-phenyl)-acetic acid (2R,3S,3a...)Show SMILES COc1cc(CC(=O)OCC2=C[C@H]3[C@H]4O[C@]5(Cc6ccccc6)O[C@]4(C[C@@H](C)[C@]3(O5)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)ccc1O |r,t:10,35,THB:23:15:26.25.24:12| Show InChI InChI=1S/C37H40O9/c1-21(2)35-17-23(4)37-27(33(35)44-36(45-35,46-37)19-24-9-7-6-8-10-24)14-26(18-34(41)30(37)13-22(3)32(34)40)20-43-31(39)16-25-11-12-28(38)29(15-25)42-5/h6-15,23,27,30,33,38,41H,1,16-20H2,2-5H3/t23-,27+,30-,33-,34-,35-,36-,37-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PDB
Article
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [3H]-RTX binding from vanilloid receptor |
Bioorg Med Chem Lett 5: 1331-1334 (1995)
Article DOI: 10.1016/0960-894X(95)00217-H
BindingDB Entry DOI: 10.7270/Q2CJ8DFC |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Transient receptor potential cation channel subfamily V member 1
(Homo sapiens (Human)) | BDBM50284628
(13-benzyl-6-hydroxy-8-[4-hydroxy-3-methoxyanilino(...)Show SMILES COc1cc(NC(=S)NCC2=C[C@H]3[C@H]4OC5(Cc6ccccc6)O[C@]4(C[C@@H](C)[C@]3(O5)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)ccc1O |t:10,35,TLB:23:15:12:24.26.25,THB:16:15:12:24.26.25| Show InChI InChI=1S/C36H40N2O7S/c1-20(2)34-16-22(4)36-26(31(34)43-35(44-34,45-36)18-23-9-7-6-8-10-23)14-24(17-33(41)29(36)13-21(3)30(33)40)19-37-32(46)38-25-11-12-27(39)28(15-25)42-5/h6-15,22,26,29,31,39,41H,1,16-19H2,2-5H3,(H2,37,38,46)/t22-,26+,29-,31-,33-,34-,35?,36-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 66 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [3H]-RTX binding from vanilloid receptor |
Bioorg Med Chem Lett 5: 1331-1334 (1995)
Article DOI: 10.1016/0960-894X(95)00217-H
BindingDB Entry DOI: 10.7270/Q2CJ8DFC |
More data for this
Ligand-Target Pair | |
Transient receptor potential cation channel subfamily V member 1
(Homo sapiens (Human)) | BDBM50284629
(13-benzyl-6-hydroxy-8-[4-hydroxy-3-methoxybenzylam...)Show SMILES COc1cc(CNC(=S)NCC2=C[C@H]3[C@H]4OC5(Cc6ccccc6)O[C@]4(C[C@@H](C)[C@]3(O5)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)ccc1O |t:11,36,TLB:24:16:13:25.27.26,THB:17:16:13:25.27.26| Show InChI InChI=1S/C37H42N2O7S/c1-21(2)35-16-23(4)37-27(32(35)44-36(45-35,46-37)18-24-9-7-6-8-10-24)14-26(17-34(42)30(37)13-22(3)31(34)41)20-39-33(47)38-19-25-11-12-28(40)29(15-25)43-5/h6-15,23,27,30,32,40,42H,1,16-20H2,2-5H3,(H2,38,39,47)/t23-,27+,30-,32-,34-,35-,36?,37-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| 149 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
Curated by ChEMBL
| Assay Description
Displacement of [3H]-RTX binding from vanilloid receptor |
Bioorg Med Chem Lett 5: 1331-1334 (1995)
Article DOI: 10.1016/0960-894X(95)00217-H
BindingDB Entry DOI: 10.7270/Q2CJ8DFC |
More data for this
Ligand-Target Pair | |
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