BDBM50407856 CHEMBL2112398

SMILES: C[C@@H](O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4(C)[C@H]3CCC12C(=O)[CH-][N+]#N

InChI Key: InChIKey=WKVYZSVMKCPHFE-RXCYGMCJSA-N

Data: 1 IC50  1 Kd

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 = 50407856   

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
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50407856 (CHEMBL2112398) Show SMILES C[C@@H](O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4(C)[C@H]3CCC12C(=O)[CH-][N+]#N |r,t:10| Show InChI InChI=1S/C22H30N2O3/c1-13(25)17-5-6-19-16-4-3-14-11-15(26)7-9-21(14,2)18(16)8-10-22(17,19)20(27)12-24-23/h11-13,16-19,25H,3-10H2,1-2H3/t13-,16-,17?,18+,19+,21?,22?/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	n/a	20	n/a	n/a	n/a	n/a	n/a
Université P. et M. Curie Curated by ChEMBL					Assay Description Affinity for recombinant Mineralocorticoid receptor				J Med Chem 39: 2860-4 (1996) Article DOI: 10.1021/jm9601359 BindingDB Entry DOI: 10.7270/Q2NK3D48
					More data for this Ligand-Target Pair
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50407856 (CHEMBL2112398) Show SMILES C[C@@H](O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4(C)[C@H]3CCC12C(=O)[CH-][N+]#N |r,t:10| Show InChI InChI=1S/C22H30N2O3/c1-13(25)17-5-6-19-16-4-3-14-11-15(26)7-9-21(14,2)18(16)8-10-22(17,19)20(27)12-24-23/h11-13,16-19,25H,3-10H2,1-2H3/t13-,16-,17?,18+,19+,21?,22?/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	900	n/a	n/a	n/a	n/a	n/a	n/a
Université P. et M. Curie Curated by ChEMBL					Assay Description Inhibition of 10e-9 M aldosterone activity in CV-1 cells expressing mineralocorticoid receptor				J Med Chem 39: 2860-4 (1996) Article DOI: 10.1021/jm9601359 BindingDB Entry DOI: 10.7270/Q2NK3D48
					More data for this Ligand-Target Pair