BDBM50362747 CHEMBL1939991

SMILES: CCOC(=O)C1C(NC(=S)N=C1c1ccccc1)c1cccc(OC)c1

InChI Key: InChIKey=ICHYZHZZUDJRPQ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50362747   

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 (Rattus norvegicus)	BDBM50362747 (CHEMBL1939991) Show SMILES CCOC(=O)C1C(NC(=S)N=C1c1ccccc1)c1cccc(OC)c1 |c:10| Show InChI InChI=1S/C20H20N2O3S/c1-3-25-19(23)16-17(13-8-5-4-6-9-13)21-20(26)22-18(16)14-10-7-11-15(12-14)24-2/h4-12,16,18H,3H2,1-2H3,(H,22,26)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Research& Development, Janssen Pharmaceutica N.V. Curated by ChEMBL					Assay Description Antagonist activity at rat TRPA1 expressed in HEK293 cells assessed as inhibition of BITC-induced increase in intracellular calcium concentration by ...				Bioorg Med Chem Lett 22: 797-800 (2012) Article DOI: 10.1016/j.bmcl.2011.12.068 BindingDB Entry DOI: 10.7270/Q2736RC4
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1 (Homo sapiens (Human))	BDBM50362747 (CHEMBL1939991) Show SMILES CCOC(=O)C1C(NC(=S)N=C1c1ccccc1)c1cccc(OC)c1 |c:10| Show InChI InChI=1S/C20H20N2O3S/c1-3-25-19(23)16-17(13-8-5-4-6-9-13)21-20(26)22-18(16)14-10-7-11-15(12-14)24-2/h4-12,16,18H,3H2,1-2H3,(H,22,26)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Research& Development, Janssen Pharmaceutica N.V. Curated by ChEMBL					Assay Description Antagonist activity at human TRPA1 expressed in HEK293 cells assessed as inhibition of 5H-dibenzo[b,e]azepine-10-carboxylic acid methyl ester-induced...				Bioorg Med Chem Lett 22: 797-800 (2012) Article DOI: 10.1016/j.bmcl.2011.12.068 BindingDB Entry DOI: 10.7270/Q2736RC4
					More data for this Ligand-Target Pair