BDBM50126461 (6R,12aR)-2-((R)-1-Benzyl-pyrrolidin-3-yl)-6-(3-methoxy-phenyl)-2,3,6,7,12,12a-hexahydro-pyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione::CHEMBL284560

SMILES: COc1cccc(c1)[C@H]1N2[C@H](Cc3c1[nH]c1ccccc31)C(=O)N(CC2=O)[C@@H]1CCN(Cc2ccccc2)C1

InChI Key: InChIKey=OPZLETNOMBODDJ-MRLTYDNFSA-N

Data: 4 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 4 hits for monomerid = 50126461   

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 11A (PDE11A) (Homo sapiens (Human))	BDBM50126461 ((6R,12aR)-2-((R)-1-Benzyl-pyrrolidin-3-yl)-6-(3-me...) Show SMILES COc1cccc(c1)[C@H]1N2[C@H](Cc3c1[nH]c1ccccc31)C(=O)N(CC2=O)[C@@H]1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C32H32N4O3/c1-39-24-11-7-10-22(16-24)31-30-26(25-12-5-6-13-27(25)33-30)17-28-32(38)35(20-29(37)36(28)31)23-14-15-34(19-23)18-21-8-3-2-4-9-21/h2-13,16,23,28,31,33H,14-15,17-20H2,1H3/t23-,28-,31-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 11 (PDE11) obtained from recombinant Sf9 expression				Bioorg Med Chem Lett 13: 1425-8 (2003) BindingDB Entry DOI: 10.7270/Q2GM86N6
					More data for this Ligand-Target Pair
Phosphodiesterase 2 and 5 (PDE2 and PDE5) (Homo sapiens (Human))	BDBM50126461 ((6R,12aR)-2-((R)-1-Benzyl-pyrrolidin-3-yl)-6-(3-me...) Show SMILES COc1cccc(c1)[C@H]1N2[C@H](Cc3c1[nH]c1ccccc31)C(=O)N(CC2=O)[C@@H]1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C32H32N4O3/c1-39-24-11-7-10-22(16-24)31-30-26(25-12-5-6-13-27(25)33-30)17-28-32(38)35(20-29(37)36(28)31)23-14-15-34(19-23)18-21-8-3-2-4-9-21/h2-13,16,23,28,31,33H,14-15,17-20H2,1H3/t23-,28-,31-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 5 (PDE5) obtained from human corpus cavernosum tissue				Bioorg Med Chem Lett 13: 1425-8 (2003) BindingDB Entry DOI: 10.7270/Q2GM86N6
					More data for this Ligand-Target Pair
Phosphodiesterase 11A (Homo sapiens (Human))	BDBM50126461 ((6R,12aR)-2-((R)-1-Benzyl-pyrrolidin-3-yl)-6-(3-me...) Show SMILES COc1cccc(c1)[C@H]1N2[C@H](Cc3c1[nH]c1ccccc31)C(=O)N(CC2=O)[C@@H]1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C32H32N4O3/c1-39-24-11-7-10-22(16-24)31-30-26(25-12-5-6-13-27(25)33-30)17-28-32(38)35(20-29(37)36(28)31)23-14-15-34(19-23)18-21-8-3-2-4-9-21/h2-13,16,23,28,31,33H,14-15,17-20H2,1H3/t23-,28-,31-/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 11 (PDE11) obtained from recombinant Sf9 expression				Bioorg Med Chem Lett 13: 1425-8 (2003) BindingDB Entry DOI: 10.7270/Q2GM86N6
					More data for this Ligand-Target Pair
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM50126461 ((6R,12aR)-2-((R)-1-Benzyl-pyrrolidin-3-yl)-6-(3-me...) Show SMILES COc1cccc(c1)[C@H]1N2[C@H](Cc3c1[nH]c1ccccc31)C(=O)N(CC2=O)[C@@H]1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C32H32N4O3/c1-39-24-11-7-10-22(16-24)31-30-26(25-12-5-6-13-27(25)33-30)17-28-32(38)35(20-29(37)36(28)31)23-14-15-34(19-23)18-21-8-3-2-4-9-21/h2-13,16,23,28,31,33H,14-15,17-20H2,1H3/t23-,28-,31-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibitory activity against phosphodiesterase 5 (PDE5) obtained from human corpus cavernosum tissue				Bioorg Med Chem Lett 13: 1425-8 (2003) BindingDB Entry DOI: 10.7270/Q2GM86N6
					More data for this Ligand-Target Pair