BDBM54731 MLS000580536::N-[3-(1H-benzimidazol-2-yl)phenyl]-2-(4-chlorophenyl)sulfanyl-ethanamide::N-[3-(1H-benzimidazol-2-yl)phenyl]-2-(4-chlorophenyl)sulfanylacetamide::N-[3-(1H-benzimidazol-2-yl)phenyl]-2-[(4-chlorophenyl)thio]acetamide::SMR000199424::cid_1288833

SMILES: Clc1ccc(SCC(=O)Nc2cccc(c2)-c2nc3ccccc3[nH]2)cc1

InChI Key: InChIKey=OLKGQFJZKSFYKF-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 54731   

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
neuronal munc18-1 binding protein (Rattus norvegicus)	BDBM54731 (MLS000580536 | N-[3-(1H-benzimidazol-2-yl)phenyl]-...) Show SMILES Clc1ccc(SCC(=O)Nc2cccc(c2)-c2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C21H16ClN3OS/c22-15-8-10-17(11-9-15)27-13-20(26)23-16-5-3-4-14(12-16)21-24-18-6-1-2-7-19(18)25-21/h1-12H,13H2,(H,23,26)(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q20P0XFH
					More data for this Ligand-Target Pair
neuronal munc18-1 binding protein (Rattus norvegicus)	BDBM54731 (MLS000580536 | N-[3-(1H-benzimidazol-2-yl)phenyl]-...) Show SMILES Clc1ccc(SCC(=O)Nc2cccc(c2)-c2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C21H16ClN3OS/c22-15-8-10-17(11-9-15)27-13-20(26)23-16-5-3-4-14(12-16)21-24-18-6-1-2-7-19(18)25-21/h1-12H,13H2,(H,23,26)(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q21V5CDC
					More data for this Ligand-Target Pair
Voltage-gated calcium channel subunit alpha Cav2.2 (Homo sapiens (Human))	BDBM54731 (MLS000580536 | N-[3-(1H-benzimidazol-2-yl)phenyl]-...) Show SMILES Clc1ccc(SCC(=O)Nc2cccc(c2)-c2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C21H16ClN3OS/c22-15-8-10-17(11-9-15)27-13-20(26)23-16-5-3-4-14(12-16)21-24-18-6-1-2-7-19(18)25-21/h1-12H,13H2,(H,23,26)(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2PZ578V
					More data for this Ligand-Target Pair