null

SMILES: Nc1ccc2c(cnn(Cc3nc(no3)[C@@H]3CO[C@H](C3)c3ccc(Cl)cc3)c2=O)n1

InChI Key: InChIKey=OMCPTRKQFMHMFO-BLLLJJGKSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 452609   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM452609 (2-amino-6-((3-((3R,5R)- 5-(4-chlorophenyl)tetra- h...) Show SMILES Nc1ccc2c(cnn(Cc3nc(no3)[C@@H]3CO[C@H](C3)c3ccc(Cl)cc3)c2=O)n1 |r| Show InChI InChI=1S/C20H17ClN6O3/c21-13-3-1-11(2-4-13)16-7-12(10-29-16)19-25-18(30-26-19)9-27-20(28)14-5-6-17(22)24-15(14)8-23-27/h1-6,8,12,16H,7,9-10H2,(H2,22,24)/t12-,16+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.5	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)
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM452609 (2-amino-6-((3-((3R,5R)- 5-(4-chlorophenyl)tetra- h...) Show SMILES Nc1ccc2c(cnn(Cc3nc(no3)[C@@H]3CO[C@H](C3)c3ccc(Cl)cc3)c2=O)n1 |r| Show InChI InChI=1S/C20H17ClN6O3/c21-13-3-1-11(2-4-13)16-7-12(10-29-16)19-25-18(30-26-19)9-27-20(28)14-5-6-17(22)24-15(14)8-23-27/h1-6,8,12,16H,7,9-10H2,(H2,22,24)/t12-,16+/m0/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 US10710994 (2020)
					More data for this Ligand-Target Pair