Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily A member 1' and Ligand = 'BDBM452917'   

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 A member 1 (Homo sapiens (Human))	BDBM452917 (7-amino-3-[[3- [(1S,5S,6R)-3-phenyl- 6-bicyclo[3.1...) Show SMILES Nc1ccc2c(ncn(Cc3nc(no3)[C@@H]3[C@H]4CC(=C[C@@H]34)c3ccccc3)c2=O)n1 |r,c:19| Show InChI InChI=1S/C22H18N6O2/c23-17-7-6-14-20(25-17)24-11-28(22(14)29)10-18-26-21(27-30-18)19-15-8-13(9-16(15)19)12-4-2-1-3-5-12/h1-8,11,15-16,19H,9-10H2,(H2,23,25)/t15-,16+,19+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...				US Patent US10711004 (2020) BindingDB Entry DOI: 10.7270/Q21839K5
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM452917 (7-amino-3-[[3- [(1S,5S,6R)-3-phenyl- 6-bicyclo[3.1...) Show SMILES Nc1ccc2c(ncn(Cc3nc(no3)[C@@H]3[C@H]4CC(=C[C@@H]34)c3ccccc3)c2=O)n1 |r,c:19| Show InChI InChI=1S/C22H18N6O2/c23-17-7-6-14-20(25-17)24-11-28(22(14)29)10-18-26-21(27-30-18)19-15-8-13(9-16(15)19)12-4-2-1-3-5-12/h1-8,11,15-16,19H,9-10H2,(H2,23,25)/t15-,16+,19+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10.5	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...				US Patent US10711004 (2020) BindingDB Entry DOI: 10.7270/Q21839K5
					More data for this Ligand-Target Pair