BDBM39489 1-(3-chlorophenyl)-3-[4-(cyanomethyl)phenyl]urea::MLS000100114::N-(3-chlorophenyl)-N'-[4-(cyanomethyl)phenyl]urea::SMR000081894::cid_1255527

SMILES: Clc1cccc(NC(=O)Nc2ccc(CC#N)cc2)c1

InChI Key: InChIKey=FWYABNDIBQSDPB-UHFFFAOYSA-N

Data: 3 EC50

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 = 39489   

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
Steroidogenic Factor 1 (Homo sapiens (Human))	BDBM39489 (1-(3-chlorophenyl)-3-[4-(cyanomethyl)phenyl]urea |...) Show SMILES Clc1cccc(NC(=O)Nc2ccc(CC#N)cc2)c1 Show InChI InChI=1S/C15H12ClN3O/c16-12-2-1-3-14(10-12)19-15(20)18-13-6-4-11(5-7-13)8-9-17/h1-7,10H,8H2,(H2,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Patents	PCBioAssay	n/a	n/a	n/a	n/a	2.43E+3	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q23T9FMP
					More data for this Ligand-Target Pair
Lysosomal acid glucosylceramidase (Homo sapiens (Human))	BDBM39489 (1-(3-chlorophenyl)-3-[4-(cyanomethyl)phenyl]urea |...) Show SMILES Clc1cccc(NC(=O)Nc2ccc(CC#N)cc2)c1 Show InChI InChI=1S/C15H12ClN3O/c16-12-2-1-3-14(10-12)19-15(20)18-13-6-4-11(5-7-13)8-9-17/h1-7,10H,8H2,(H2,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Patents	PCBioAssay	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q23J3BC8
					More data for this Ligand-Target Pair
Nuclear receptor ROR-alpha (Homo sapiens (Human))	BDBM39489 (1-(3-chlorophenyl)-3-[4-(cyanomethyl)phenyl]urea |...) Show SMILES Clc1cccc(NC(=O)Nc2ccc(CC#N)cc2)c1 Show InChI InChI=1S/C15H12ClN3O/c16-12-2-1-3-14(10-12)19-15(20)18-13-6-4-11(5-7-13)8-9-17/h1-7,10H,8H2,(H2,18,19,20)	PDB MMDB Reactome pathway KEGG B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Patents	PCBioAssay	n/a	n/a	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q24T6GSH
					More data for this Ligand-Target Pair