Compile Data Set for Download or QSAR

Found 19 hits Enz. Inhib. hit(s) with all data for entry = 50028025   

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))	BDBM50255472 ((S)-1-oxo-3-phenyl-2-(pyridin-2-yl)-N-(4-(trifluor...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccn2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C26H23F3N4O2/c27-26(28,29)19-9-11-20(12-10-19)31-24(35)32-16-13-25(14-17-32)22(18-6-2-1-3-7-18)33(23(25)34)21-8-4-5-15-30-21/h1-12,15,22H,13-14,16-17H2,(H,31,35)/t22-/m0/s1	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	8.5	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255380 ((S)-N-(4-tert-butylphenyl)-1-oxo-2,3-diphenyl-2,7-...) Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccc2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C30H33N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-17,26H,18-21H2,1-3H3,(H,31,35)/t26-/m0/s1	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	9.40	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255380 ((S)-N-(4-tert-butylphenyl)-1-oxo-2,3-diphenyl-2,7-...) Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccc2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C30H33N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-17,26H,18-21H2,1-3H3,(H,31,35)/t26-/m0/s1	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	12	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255472 ((S)-1-oxo-3-phenyl-2-(pyridin-2-yl)-N-(4-(trifluor...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccn2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C26H23F3N4O2/c27-26(28,29)19-9-11-20(12-10-19)31-24(35)32-16-13-25(14-17-32)22(18-6-2-1-3-7-18)33(23(25)34)21-8-4-5-15-30-21/h1-12,15,22H,13-14,16-17H2,(H,31,35)/t22-/m0/s1	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	13	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255382 ((S)-N-((1r,4S)-4-tert-butylcyclohexyl)-1-oxo-2,3-d...) Show SMILES CC(C)(C)[C@H]1CC[C@@H](CC1)NC(=O)N1CCC2(CC1)[C@@H](N(C2=O)c1ccccc1)c1ccccc1 |r,wU:4.3,19.32,wD:7.10,(30.29,-16.11,;28.97,-15.34,;28.2,-16.68,;29.75,-14.01,;27.63,-14.57,;26.3,-15.34,;24.97,-14.57,;24.97,-13.03,;26.3,-12.26,;27.63,-13.03,;23.64,-12.26,;22.31,-13.03,;22.31,-14.57,;20.97,-12.26,;19.65,-13.02,;18.32,-12.26,;18.31,-10.71,;19.65,-9.94,;20.97,-10.72,;17.54,-9.38,;16.2,-10.15,;16.98,-11.49,;16.58,-12.98,;14.71,-9.77,;14.31,-8.28,;12.83,-7.88,;11.74,-8.98,;12.15,-10.47,;13.63,-10.86,;17.93,-7.89,;19.42,-7.49,;19.81,-6,;18.72,-4.92,;17.23,-5.33,;16.84,-6.81,)| Show InChI InChI=1S/C30H39N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-13,23-24,26H,14-21H2,1-3H3,(H,31,35)/t23-,24-,26-/m0/s1	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	32	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255521 ((S)-N-(4-isopropylphenyl)-1-oxo-2,3-diphenyl-2,7-d...) Show SMILES CC(C)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccc2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C29H31N3O2/c1-21(2)22-13-15-24(16-14-22)30-28(34)31-19-17-29(18-20-31)26(23-9-5-3-6-10-23)32(27(29)33)25-11-7-4-8-12-25/h3-16,21,26H,17-20H2,1-2H3,(H,30,34)/t26-/m0/s1	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	43	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255382 ((S)-N-((1r,4S)-4-tert-butylcyclohexyl)-1-oxo-2,3-d...) Show SMILES CC(C)(C)[C@H]1CC[C@@H](CC1)NC(=O)N1CCC2(CC1)[C@@H](N(C2=O)c1ccccc1)c1ccccc1 |r,wU:4.3,19.32,wD:7.10,(30.29,-16.11,;28.97,-15.34,;28.2,-16.68,;29.75,-14.01,;27.63,-14.57,;26.3,-15.34,;24.97,-14.57,;24.97,-13.03,;26.3,-12.26,;27.63,-13.03,;23.64,-12.26,;22.31,-13.03,;22.31,-14.57,;20.97,-12.26,;19.65,-13.02,;18.32,-12.26,;18.31,-10.71,;19.65,-9.94,;20.97,-10.72,;17.54,-9.38,;16.2,-10.15,;16.98,-11.49,;16.58,-12.98,;14.71,-9.77,;14.31,-8.28,;12.83,-7.88,;11.74,-8.98,;12.15,-10.47,;13.63,-10.86,;17.93,-7.89,;19.42,-7.49,;19.81,-6,;18.72,-4.92,;17.23,-5.33,;16.84,-6.81,)| Show InChI InChI=1S/C30H39N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-13,23-24,26H,14-21H2,1-3H3,(H,31,35)/t23-,24-,26-/m0/s1	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	49	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255471 (CHEMBL518965 | N-(4-tert-butylphenyl)-1-oxo-2-phen...) Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCC3(CN(C3=O)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C24H29N3O2/c1-23(2,3)18-9-11-19(12-10-18)25-22(29)26-15-13-24(14-16-26)17-27(21(24)28)20-7-5-4-6-8-20/h4-12H,13-17H2,1-3H3,(H,25,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255471 (CHEMBL518965 | N-(4-tert-butylphenyl)-1-oxo-2-phen...) Show SMILES CC(C)(C)c1ccc(NC(=O)N2CCC3(CN(C3=O)c3ccccc3)CC2)cc1 Show InChI InChI=1S/C24H29N3O2/c1-23(2,3)18-9-11-19(12-10-18)25-22(29)26-15-13-24(14-16-26)17-27(21(24)28)20-7-5-4-6-8-20/h4-12H,13-17H2,1-3H3,(H,25,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255521 ((S)-N-(4-isopropylphenyl)-1-oxo-2,3-diphenyl-2,7-d...) Show SMILES CC(C)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccc2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C29H31N3O2/c1-21(2)22-13-15-24(16-14-22)30-28(34)31-19-17-29(18-20-31)26(23-9-5-3-6-10-23)32(27(29)33)25-11-7-4-8-12-25/h3-16,21,26H,17-20H2,1-2H3,(H,30,34)/t26-/m0/s1	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	81	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255428 (CHEMBL479851 | rac-1-oxo-2,3-diphenyl-N-(4-(triflu...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H24F3N3O2/c28-27(29,30)20-11-13-21(14-12-20)31-25(35)32-17-15-26(16-18-32)23(19-7-3-1-4-8-19)33(24(26)34)22-9-5-2-6-10-22/h1-14,23H,15-18H2,(H,31,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	85	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255381 (CHEMBL479646 | N-(4-isopropylphenyl)-1-oxo-2,3-dip...) Show SMILES CC(C)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C29H31N3O2/c1-21(2)22-13-15-24(16-14-22)30-28(34)31-19-17-29(18-20-31)26(23-9-5-3-6-10-23)32(27(29)33)25-11-7-4-8-12-25/h3-16,21,26H,17-20H2,1-2H3,(H,30,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	101	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255428 (CHEMBL479851 | rac-1-oxo-2,3-diphenyl-N-(4-(triflu...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C27H24F3N3O2/c28-27(29,30)20-11-13-21(14-12-20)31-25(35)32-17-15-26(16-18-32)23(19-7-3-1-4-8-19)33(24(26)34)22-9-5-2-6-10-22/h1-14,23H,15-18H2,(H,31,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255381 (CHEMBL479646 | N-(4-isopropylphenyl)-1-oxo-2,3-dip...) Show SMILES CC(C)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)cc1 Show InChI InChI=1S/C29H31N3O2/c1-21(2)22-13-15-24(16-14-22)30-28(34)31-19-17-29(18-20-31)26(23-9-5-3-6-10-23)32(27(29)33)25-11-7-4-8-12-25/h3-16,21,26H,17-20H2,1-2H3,(H,30,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255429 (CHEMBL516759 | rac-1-oxo-2,3-diphenyl-N-(6-(triflu...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)nc1 Show InChI InChI=1S/C26H23F3N4O2/c27-26(28,29)19-11-12-21(30-17-19)31-24(35)32-15-13-25(14-16-32)22(18-7-3-1-4-8-18)33(23(25)34)20-9-5-2-6-10-20/h1-12,17,22H,13-16H2,(H,30,31,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	205	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255427 ((S)-1-oxo-2,3-diphenyl-N-(4-(2-phenylpropan-2-yl)p...) Show SMILES CC(C)(c1ccccc1)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](N(C3=O)c2ccccc2)c2ccccc2)cc1 |r| Show InChI InChI=1S/C35H35N3O2/c1-34(2,27-14-8-4-9-15-27)28-18-20-29(21-19-28)36-33(40)37-24-22-35(23-25-37)31(26-12-6-3-7-13-26)38(32(35)39)30-16-10-5-11-17-30/h3-21,31H,22-25H2,1-2H3,(H,36,40)/t31-/m0/s1	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	226	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255426 ((S)-N-((1s,4R)-4-tert-butylcyclohexyl)-1-oxo-2,3-d...) Show SMILES CC(C)(C)[C@@H]1CC[C@@H](CC1)NC(=O)N1CCC2(CC1)[C@@H](N(C2=O)c1ccccc1)c1ccccc1 |r,wU:19.32,wD:7.10,4.3,(9.96,-26.87,;8.63,-26.11,;7.86,-27.44,;9.41,-24.78,;7.3,-25.34,;5.96,-26.11,;4.63,-25.33,;4.64,-23.8,;5.96,-23.03,;7.29,-23.79,;3.3,-23.03,;1.97,-23.79,;1.97,-25.33,;.64,-23.02,;-.69,-23.78,;-2.02,-23.02,;-2.03,-21.48,;-.69,-20.7,;.64,-21.48,;-2.8,-20.14,;-4.14,-20.92,;-3.36,-22.26,;-3.76,-23.75,;-5.63,-20.53,;-6.03,-19.04,;-7.51,-18.65,;-8.6,-19.74,;-8.19,-21.23,;-6.7,-21.62,;-2.41,-18.66,;-.92,-18.26,;-.53,-16.77,;-1.62,-15.68,;-3.11,-16.09,;-3.5,-17.58,)| Show InChI InChI=1S/C30H39N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-13,23-24,26H,14-21H2,1-3H3,(H,31,35)/t23-,24+,26-/m0/s1	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	232	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255429 (CHEMBL516759 | rac-1-oxo-2,3-diphenyl-N-(6-(triflu...) Show SMILES FC(F)(F)c1ccc(NC(=O)N2CCC3(CC2)C(N(C3=O)c2ccccc2)c2ccccc2)nc1 Show InChI InChI=1S/C26H23F3N4O2/c27-26(28,29)19-11-12-21(30-17-19)31-24(35)32-15-13-25(14-16-32)22(18-7-3-1-4-8-18)33(23(25)34)20-9-5-2-6-10-20/h1-12,17,22H,13-16H2,(H,30,31,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	318	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 expressed in HEK293 cells assessed as inhibition of PMA-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM50255426 ((S)-N-((1s,4R)-4-tert-butylcyclohexyl)-1-oxo-2,3-d...) Show SMILES CC(C)(C)[C@@H]1CC[C@@H](CC1)NC(=O)N1CCC2(CC1)[C@@H](N(C2=O)c1ccccc1)c1ccccc1 |r,wU:19.32,wD:7.10,4.3,(9.96,-26.87,;8.63,-26.11,;7.86,-27.44,;9.41,-24.78,;7.3,-25.34,;5.96,-26.11,;4.63,-25.33,;4.64,-23.8,;5.96,-23.03,;7.29,-23.79,;3.3,-23.03,;1.97,-23.79,;1.97,-25.33,;.64,-23.02,;-.69,-23.78,;-2.02,-23.02,;-2.03,-21.48,;-.69,-20.7,;.64,-21.48,;-2.8,-20.14,;-4.14,-20.92,;-3.36,-22.26,;-3.76,-23.75,;-5.63,-20.53,;-6.03,-19.04,;-7.51,-18.65,;-8.6,-19.74,;-8.19,-21.23,;-6.7,-21.62,;-2.41,-18.66,;-.92,-18.26,;-.53,-16.77,;-1.62,-15.68,;-3.11,-16.09,;-3.5,-17.58,)| Show InChI InChI=1S/C30H39N3O2/c1-29(2,3)23-14-16-24(17-15-23)31-28(35)32-20-18-30(19-21-32)26(22-10-6-4-7-11-22)33(27(30)34)25-12-8-5-9-13-25/h4-13,23-24,26H,14-21H2,1-3H3,(H,31,35)/t23-,24+,26-/m0/s1	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	528	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Antagonist activity at TRPV1 (unknown origin) expressed in HEK293 cells assessed as inhibition of capsaicin-induced activation by FLIPR assay				Bioorg Med Chem Lett 19: 783-7 (2009) Article DOI: 10.1016/j.bmcl.2008.12.024 BindingDB Entry DOI: 10.7270/Q2F47P1D
					More data for this Ligand-Target Pair