BDBM50134131 (3aR,10S)-2-Benzyl-10-(4-methoxy-phenyl)-1,2,3a,4,9,10-hexahydro-2,9,10a-triaza-cyclopenta[b]fluoren-3-one::CHEMBL342876

SMILES: COc1ccc(cc1)[C@@H]1N2CN(Cc3ccccc3)C(=O)[C@H]2Cc2c1[nH]c1ccccc21

InChI Key: InChIKey=AEIPBGWCBLFAEY-RSXGOPAZSA-N

Data: 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 1 hit for monomerid = 50134131   

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
Phosphodiesterase 5A (Bos taurus)	BDBM50134131 ((3aR,10S)-2-Benzyl-10-(4-methoxy-phenyl)-1,2,3a,4,...) Show SMILES COc1ccc(cc1)[C@@H]1N2CN(Cc3ccccc3)C(=O)[C@H]2Cc2c1[nH]c1ccccc21 Show InChI InChI=1S/C27H25N3O2/c1-32-20-13-11-19(12-14-20)26-25-22(21-9-5-6-10-23(21)28-25)15-24-27(31)29(17-30(24)26)16-18-7-3-2-4-8-18/h2-14,24,26,28H,15-17H2,1H3/t24-,26+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherches Curated by ChEMBL					Assay Description In vitro inhibitory activity against bovine phosphodiesterase 5				J Med Chem 46: 4533-42 (2003) Article DOI: 10.1021/jm0300577 BindingDB Entry DOI: 10.7270/Q2N015X2
					More data for this Ligand-Target Pair