BDBM50066529 3-(2,2,4-Trimethyl-1,2-dihydro-quinolin-6-yl)-benzonitrile::3-(2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)benzonitrile::CHEMBL115904

SMILES: CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)C#N

InChI Key: InChIKey=PDEIPQPDODOWPI-UHFFFAOYSA-N

Data: 2 KI  1 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 = 50066529   

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))	BDBM50066529 (3-(2,2,4-Trimethyl-1,2-dihydro-quinolin-6-yl)-benz...) Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)C#N |t:1| Show InChI InChI=1S/C19H18N2/c1-13-11-19(2,3)21-18-8-7-16(10-17(13)18)15-6-4-5-14(9-15)12-20/h4-11,21H,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Binding affinity against Baculovirus-Expressed hPR-A				J Med Chem 41: 3461-6 (1998) Article DOI: 10.1021/jm9801915 BindingDB Entry DOI: 10.7270/Q2KD1ZKM
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50066529 (3-(2,2,4-Trimethyl-1,2-dihydro-quinolin-6-yl)-benz...) Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)C#N |t:1| Show InChI InChI=1S/C19H18N2/c1-13-11-19(2,3)21-18-8-7-16(10-17(13)18)15-6-4-5-14(9-15)12-20/h4-11,21H,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Scientific Computing Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]progesterone from Progesterone receptor				J Med Chem 49: 4261-8 (2006) Article DOI: 10.1021/jm060234e BindingDB Entry DOI: 10.7270/Q2V69NB6
					More data for this Ligand-Target Pair
Progesterone receptor (Homo sapiens (Human))	BDBM50066529 (3-(2,2,4-Trimethyl-1,2-dihydro-quinolin-6-yl)-benz...) Show SMILES CC1=CC(C)(C)Nc2ccc(cc12)-c1cccc(c1)C#N |t:1| Show InChI InChI=1S/C19H18N2/c1-13-11-19(2,3)21-18-8-7-16(10-17(13)18)15-6-4-5-14(9-15)12-20/h4-11,21H,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc. Curated by ChEMBL					Assay Description In vitro antagonist activity against human progesterone receptor isoform B(hPR-B) in mammalian(CV-1) cells				J Med Chem 41: 3461-6 (1998) Article DOI: 10.1021/jm9801915 BindingDB Entry DOI: 10.7270/Q2KD1ZKM
					More data for this Ligand-Target Pair