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 = 'BDBM452647'   

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))	BDBM452647 (2-amino-1-((3-((3R,5R)- 5-(3-fluorophenyl) tetrahy...) Show SMILES Cn1cnc2nc(N)n(Cc3nc(no3)[C@@H]3CO[C@H](C3)c3cccc(F)c3)c(=O)c12 |r| Show InChI InChI=1S/C19H18FN7O3/c1-26-9-22-17-15(26)18(28)27(19(21)24-17)7-14-23-16(25-30-14)11-6-13(29-8-11)10-3-2-4-12(20)5-10/h2-5,9,11,13H,6-8H2,1H3,(H2,21,24)/t11-,13+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	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 US10710994 (2020) BindingDB Entry DOI: 10.7270/Q251429W
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM452647 (2-amino-1-((3-((3R,5R)- 5-(3-fluorophenyl) tetrahy...) Show SMILES Cn1cnc2nc(N)n(Cc3nc(no3)[C@@H]3CO[C@H](C3)c3cccc(F)c3)c(=O)c12 |r| Show InChI InChI=1S/C19H18FN7O3/c1-26-9-22-17-15(26)18(28)27(19(21)24-17)7-14-23-16(25-30-14)11-6-13(29-8-11)10-3-2-4-12(20)5-10/h2-5,9,11,13H,6-8H2,1H3,(H2,21,24)/t11-,13+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	40.5	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 US10710994 (2020) BindingDB Entry DOI: 10.7270/Q251429W
					More data for this Ligand-Target Pair