Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM245124'   

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 (Rattus norvegicus (rat))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	37
Janssen Pharmaceutica NV US Patent					Assay Description The assay was performed as described below, using HEK293 cells transfected with rat TRPV1 (rTRPV1/HEK293). These cells had a geneticin selection mark...				US Patent US9422293 (2016) BindingDB Entry DOI: 10.7270/Q2P55MD8
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Rattus norvegicus (rat))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA N.V. US Patent					Assay Description The assay was performed as described above, using HEK293 cells transfected with rat TRPV1 (rTRPV1/HEK293). These cells had a geneticin selection mark...				US Patent US9738649 (2017) BindingDB Entry DOI: 10.7270/Q2G73GVH
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Rattus norvegicus (rat))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	37
Janssen Pharmaceutica NV US Patent					Assay Description The assay was performed as described below, using HEK293 cells transfected with rat TRPV1 (rTRPV1/HEK293). These cells had a geneticin selection mark...				US Patent US9422293 (2016) BindingDB Entry DOI: 10.7270/Q2P55MD8
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Rattus norvegicus (rat))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA N.V. US Patent					Assay Description The assay was performed as described above, using HEK293 cells transfected with rat TRPV1 (rTRPV1/HEK293). These cells had a geneticin selection mark...				US Patent US9738649 (2017) BindingDB Entry DOI: 10.7270/Q2G73GVH
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA N.V. US Patent					Assay Description HEK293 cells were transfected with human TRPV1 cloned in pcDNA3.1zeo(+) using the Effectene non-liposomal lipid based transfection kit (Qiagen) (hTRP...				US Patent US9738649 (2017) BindingDB Entry DOI: 10.7270/Q2G73GVH
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	37
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 cells were transfected with human TRPV1 cloned in pcDNA3.1zeo(+) using the Effectene non-liposomal lipid based transfection kit (Qiagen) (hTRP...				US Patent US9422293 (2016) BindingDB Entry DOI: 10.7270/Q2P55MD8
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
JANSSEN PHARMACEUTICA N.V. US Patent					Assay Description HEK293 cells were transfected with human TRPV1 cloned in pcDNA3.1zeo(+) using the Effectene non-liposomal lipid based transfection kit (Qiagen) (hTRP...				US Patent US9738649 (2017) BindingDB Entry DOI: 10.7270/Q2G73GVH
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1 (Homo sapiens (Human))	BDBM245124 (US9422293, 368 | US9422293, 369 | US9738649, Examp...) Show SMILES CC1OCCC1Sc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F Show InChI InChI=1S/C27H27F6N5OS/c1-15-14-17(26(28,29)30)5-6-20(15)35-23-18-7-11-38(24-19(27(31,32)33)4-3-10-34-24)12-8-21(18)36-25(37-23)40-22-9-13-39-16(22)2/h3-6,10,14,16,22H,7-9,11-13H2,1-2H3,(H,35,36,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	37
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 cells were transfected with human TRPV1 cloned in pcDNA3.1zeo(+) using the Effectene non-liposomal lipid based transfection kit (Qiagen) (hTRP...				US Patent US9422293 (2016) BindingDB Entry DOI: 10.7270/Q2P55MD8
					More data for this Ligand-Target Pair