BDBM76013 MLS001123499::N-(3-methylsulfanylphenyl)-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide::N-[3-(methylthio)phenyl]-4-(1-piperidinylsulfonyl)-1H-pyrrole-2-carboxamide::N-[3-(methylthio)phenyl]-4-piperidinosulfonyl-1H-pyrrole-2-carboxamide::SMR000627616::cid_22552026

SMILES: CSc1cccc(NC(=O)c2cc(c[nH]2)S(=O)(=O)N2CCCCC2)c1

InChI Key: InChIKey=MOHKKXQLDAIOGM-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 = 76013   

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
Photoreceptor-specific nuclear receptor (Homo sapiens (Human))	BDBM76013 (MLS001123499 | N-(3-methylsulfanylphenyl)-4-piperi...) Show SMILES CSc1cccc(NC(=O)c2cc(c[nH]2)S(=O)(=O)N2CCCCC2)c1 Show InChI InChI=1S/C17H21N3O3S2/c1-24-14-7-5-6-13(10-14)19-17(21)16-11-15(12-18-16)25(22,23)20-8-3-2-4-9-20/h5-7,10-12,18H,2-4,8-9H2,1H3,(H,19,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.45E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2BK19S0
					More data for this Ligand-Target Pair
Nuclear receptor corepressor 2 (TRAC-1) (Homo sapiens (Human))	BDBM76013 (MLS001123499 | N-(3-methylsulfanylphenyl)-4-piperi...) Show SMILES CSc1cccc(NC(=O)c2cc(c[nH]2)S(=O)(=O)N2CCCCC2)c1 Show InChI InChI=1S/C17H21N3O3S2/c1-24-14-7-5-6-13(10-14)19-17(21)16-11-15(12-18-16)25(22,23)20-8-3-2-4-9-20/h5-7,10-12,18H,2-4,8-9H2,1H3,(H,19,21)	PDB MMDB B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	PCBioAssay	n/a	n/a	4.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q26T0K34
					More data for this Ligand-Target Pair