BDBM50169735 (4-tert-Butyl-benzyl)-thiocarbamic acid 4-methanesulfonylamino-benzyl ester::CHEMBL190536

SMILES: CC(C)(C)c1ccc(CNC(=S)OCc2ccc(NS(C)(=O)=O)cc2)cc1

InChI Key: InChIKey=PDTVJOZRTUBDJZ-UHFFFAOYSA-N

Data: 2 KI

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 = 50169735   

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
Vanilloid receptor (Rattus norvegicus (rat))	BDBM50169735 ((4-tert-Butyl-benzyl)-thiocarbamic acid 4-methanes...) Show SMILES CC(C)(C)c1ccc(CNC(=S)OCc2ccc(NS(C)(=O)=O)cc2)cc1 Show InChI InChI=1S/C20H26N2O3S2/c1-20(2,3)17-9-5-15(6-10-17)13-21-19(26)25-14-16-7-11-18(12-8-16)22-27(4,23)24/h5-12,22H,13-14H2,1-4H3,(H,21,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	222	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Antagonist activity towards rat TRPV1 expressed in CHO cells				Bioorg Med Chem Lett 15: 4143-50 (2005) Article DOI: 10.1016/j.bmcl.2005.06.006 BindingDB Entry DOI: 10.7270/Q2JH3KQB
					More data for this Ligand-Target Pair
Vanilloid receptor (Rattus norvegicus (rat))	BDBM50169735 ((4-tert-Butyl-benzyl)-thiocarbamic acid 4-methanes...) Show SMILES CC(C)(C)c1ccc(CNC(=S)OCc2ccc(NS(C)(=O)=O)cc2)cc1 Show InChI InChI=1S/C20H26N2O3S2/c1-20(2,3)17-9-5-15(6-10-17)13-21-19(26)25-14-16-7-11-18(12-8-16)22-27(4,23)24/h5-12,22H,13-14H2,1-4H3,(H,21,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	772	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description In vitro inhibition of [3H]-RTX binding to rat TRPV1 expressed in CHO cells				Bioorg Med Chem Lett 15: 4143-50 (2005) Article DOI: 10.1016/j.bmcl.2005.06.006 BindingDB Entry DOI: 10.7270/Q2JH3KQB
					More data for this Ligand-Target Pair