BDBM50344313 CHEMBL1779431::rac-4a-Methyl-4,4a,5,6-tetrahydro-2H-1,2,7,7a-tetraaza-benzo[c]fluoren-3-one

SMILES: CC12CCc3nn4ccccc4c3C1=NNC(=O)C2

InChI Key: InChIKey=SDXDHFGYMNLOKM-UHFFFAOYSA-N

Data: 3 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 = 50344313   

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
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50344313 (CHEMBL1779431 | rac-4a-Methyl-4,4a,5,6-tetrahydro-...) Show SMILES CC12CCc3nn4ccccc4c3C1=NNC(=O)C2 |c:16| Show InChI InChI=1S/C14H14N4O/c1-14-6-5-9-12(13(14)16-15-11(19)8-14)10-4-2-3-7-18(10)17-9/h2-4,7H,5-6,8H2,1H3,(H,15,19)	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	>4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Heriot-Watt University Curated by ChEMBL					Assay Description Inhibition of human PDE5A catalytic domain using cAMP/cGMP substrate				Bioorg Med Chem Lett 21: 3307-12 (2011) Article DOI: 10.1016/j.bmcl.2011.04.021 BindingDB Entry DOI: 10.7270/Q2X067C3
					More data for this Ligand-Target Pair
3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50344313 (CHEMBL1779431 | rac-4a-Methyl-4,4a,5,6-tetrahydro-...) Show SMILES CC12CCc3nn4ccccc4c3C1=NNC(=O)C2 |c:16| Show InChI InChI=1S/C14H14N4O/c1-14-6-5-9-12(13(14)16-15-11(19)8-14)10-4-2-3-7-18(10)17-9/h2-4,7H,5-6,8H2,1H3,(H,15,19)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heriot-Watt University Curated by ChEMBL					Assay Description Inhibition of human PDE4B catalytic domain using cAMP/cGMP substrate				Bioorg Med Chem Lett 21: 3307-12 (2011) Article DOI: 10.1016/j.bmcl.2011.04.021 BindingDB Entry DOI: 10.7270/Q2X067C3
					More data for this Ligand-Target Pair
Phosphodiesterase 3 (PDE3) (Homo sapiens (Human))	BDBM50344313 (CHEMBL1779431 | rac-4a-Methyl-4,4a,5,6-tetrahydro-...) Show SMILES CC12CCc3nn4ccccc4c3C1=NNC(=O)C2 |c:16| Show InChI InChI=1S/C14H14N4O/c1-14-6-5-9-12(13(14)16-15-11(19)8-14)10-4-2-3-7-18(10)17-9/h2-4,7H,5-6,8H2,1H3,(H,15,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Heriot-Watt University Curated by ChEMBL					Assay Description Inhibition of human PDE3A catalytic domain using cAMP/cGMP substrate				Bioorg Med Chem Lett 21: 3307-12 (2011) Article DOI: 10.1016/j.bmcl.2011.04.021 BindingDB Entry DOI: 10.7270/Q2X067C3
					More data for this Ligand-Target Pair