BDBM50134121 (3aR,10R)-2-Butyl-10-pyridin-3-yl-3a,4,9,10-tetrahydro-2,9,10a-triaza-cyclopenta[b]fluorene-1,3-dione::CHEMBL140493::Cis-2-Butyl-10-pyridin-3-yl-3a,4,9,10-tetrahydro-2,9,10a-triaza-cyclopenta[b]fluorene-1,3-dione

SMILES: CCCCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3cccnc3)n2c1=O

InChI Key: InChIKey=NOTZSIPWQIUINI-HXUWFJFHSA-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 = 50134121   

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)	BDBM50134121 ((3aR,10R)-2-Butyl-10-pyridin-3-yl-3a,4,9,10-tetrah...) Show SMILES CCCCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3cccnc3)n2c1=O |r| Show InChI InChI=1S/C22H22N4O2/c1-2-3-11-25-21(27)18-12-16-15-8-4-5-9-17(15)24-19(16)20(26(18)22(25)28)14-7-6-10-23-13-14/h4-10,13,20,24,27H,2-3,11-12H2,1H3/t20-/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	90	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherches Curated by ChEMBL					Assay Description Inhibitory activity against bovine PDE5 (phosphodiesterase-5).				J Med Chem 46: 4525-32 (2003) Article DOI: 10.1021/jm030056e BindingDB Entry DOI: 10.7270/Q2NP255G
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50134121 ((3aR,10R)-2-Butyl-10-pyridin-3-yl-3a,4,9,10-tetrah...) Show SMILES CCCCn1c(O)c2Cc3c([nH]c4ccccc34)[C@@H](c3cccnc3)n2c1=O |r| Show InChI InChI=1S/C22H22N4O2/c1-2-3-11-25-21(27)18-12-16-15-8-4-5-9-17(15)24-19(16)20(26(18)22(25)28)14-7-6-10-23-13-14/h4-10,13,20,24,27H,2-3,11-12H2,1H3/t20-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	91	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Lavras-UFLA Curated by ChEMBL					Assay Description Inhibition of PDE5				Bioorg Med Chem 16: 7599-606 (2008) Article DOI: 10.1016/j.bmc.2008.07.022 BindingDB Entry DOI: 10.7270/Q2VX0HRR
					More data for this Ligand-Target Pair