BDBM50013421 CHEMBL3263759

SMILES: COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C(C)C)c1ccc(C#N)c(C)n1

InChI Key: InChIKey=STIUBRUMWDMBIN-QGZVFWFLSA-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 = 50013421   

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))	BDBM50013421 (CHEMBL3263759) Show SMILES COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C(C)C)c1ccc(C#N)c(C)n1 |r,t:12| Show InChI InChI=1S/C20H21N5O3/c1-11(2)17-9-16(15-7-6-14(20(26)27)19(23-15)28-4)24-25(17)18-8-5-13(10-21)12(3)22-18/h5-8,11,17H,9H2,1-4H3,(H,26,27)/t17-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at progesterone receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50013421 (CHEMBL3263759) Show SMILES COc1nc(ccc1C(O)=O)C1=NN([C@H](C1)C(C)C)c1ccc(C#N)c(C)n1 |r,t:12| Show InChI InChI=1S/C20H21N5O3/c1-11(2)17-9-16(15-7-6-14(20(26)27)19(23-15)28-4)24-25(17)18-8-5-13(10-21)12(3)22-18/h5-8,11,17H,9H2,1-4H3,(H,26,27)/t17-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor (unknown origin) by Gal4-based cellular assay				J Med Chem 57: 4273-88 (2014) Article DOI: 10.1021/jm500206r BindingDB Entry DOI: 10.7270/Q2D50PGM
					More data for this Ligand-Target Pair