BDBM50298212 (S)-2-chloro-4-((2-fluorobenzyl)(1-methyl-5-oxopyrrolidin-3-yl)amino)benzonitrile::CHEMBL563283

SMILES: CN1C[C@H](CC1=O)N(Cc1ccccc1F)c1ccc(C#N)c(Cl)c1

InChI Key: InChIKey=XAYOEIVNFJSYCT-INIZCTEOSA-N

Data: 2 IC50  1 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 = 50298212   

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
Progesterone receptor (Homo sapiens (Human))	BDBM50298212 ((S)-2-chloro-4-((2-fluorobenzyl)(1-methyl-5-oxopyr...) Show SMILES CN1C[C@H](CC1=O)N(Cc1ccccc1F)c1ccc(C#N)c(Cl)c1 |r| Show InChI InChI=1S/C19H17ClFN3O/c1-23-12-16(9-19(23)25)24(11-14-4-2-3-5-18(14)21)15-7-6-13(10-22)17(20)8-15/h2-8,16H,9,11-12H2,1H3/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity to progesterone receptor				Bioorg Med Chem Lett 19: 4664-8 (2009) Article DOI: 10.1016/j.bmcl.2009.06.081 BindingDB Entry DOI: 10.7270/Q25H7G9T
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50298212 ((S)-2-chloro-4-((2-fluorobenzyl)(1-methyl-5-oxopyr...) Show SMILES CN1C[C@H](CC1=O)N(Cc1ccccc1F)c1ccc(C#N)c(Cl)c1 |r| Show InChI InChI=1S/C19H17ClFN3O/c1-23-12-16(9-19(23)25)24(11-14-4-2-3-5-18(14)21)15-7-6-13(10-22)17(20)8-15/h2-8,16H,9,11-12H2,1H3/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human ERG by whole cell patch clamp assay				Bioorg Med Chem Lett 19: 4664-8 (2009) Article DOI: 10.1016/j.bmcl.2009.06.081 BindingDB Entry DOI: 10.7270/Q25H7G9T
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50298212 ((S)-2-chloro-4-((2-fluorobenzyl)(1-methyl-5-oxopyr...) Show SMILES CN1C[C@H](CC1=O)N(Cc1ccccc1F)c1ccc(C#N)c(Cl)c1 |r| Show InChI InChI=1S/C19H17ClFN3O/c1-23-12-16(9-19(23)25)24(11-14-4-2-3-5-18(14)21)15-7-6-13(10-22)17(20)8-15/h2-8,16H,9,11-12H2,1H3/t16-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	135	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Agonist activity at progesterone receptor in human T47D cells assessed as inhibition of progesterone-induced alkaline phosphatase activity				Bioorg Med Chem Lett 19: 4664-8 (2009) Article DOI: 10.1016/j.bmcl.2009.06.081 BindingDB Entry DOI: 10.7270/Q25H7G9T
					More data for this Ligand-Target Pair