BDBM50169624 1-Cyclopentyl-6-[2-ethoxy-5-(4-methyl-piperazine-1-sulfonyl)-phenyl]-3-ethyl-1,5-dihydro-pyrazolo[3,4-d]pyrimidin-4-one::CHEMBL183096
SMILES: CCOc1ccc(cc1-c1nc2n(nc(CC)c2c(=O)[nH]1)C1CCCC1)S(=O)(=O)N1CCN(C)CC1
InChI Key: InChIKey=MMCFWOPLWHFLMT-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50169624 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 1
(Homo sapiens (Human)) | BDBM50169624
(1-Cyclopentyl-6-[2-ethoxy-5-(4-methyl-piperazine-1...)Show SMILES CCOc1ccc(cc1-c1nc2n(nc(CC)c2c(=O)[nH]1)C1CCCC1)S(=O)(=O)N1CCN(C)CC1 Show InChI InChI=1S/C25H34N6O4S/c1-4-20-22-24(31(28-20)17-8-6-7-9-17)26-23(27-25(22)32)19-16-18(10-11-21(19)35-5-2)36(33,34)30-14-12-29(3)13-15-30/h10-11,16-17H,4-9,12-15H2,1-3H3,(H,26,27,32) | PDB MMDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
BAYER HealthCare AG
Curated by ChEMBL
| Assay Description Inhibition of phosphodiesterase 1 |
Bioorg Med Chem Lett 15: 3900-7 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.090 BindingDB Entry DOI: 10.7270/Q2XS5TWD |
More data for this Ligand-Target Pair | |
cGMP-specific 3',5'-cyclic phosphodiesterase
(Homo sapiens (Human)) | BDBM50169624
(1-Cyclopentyl-6-[2-ethoxy-5-(4-methyl-piperazine-1...)Show SMILES CCOc1ccc(cc1-c1nc2n(nc(CC)c2c(=O)[nH]1)C1CCCC1)S(=O)(=O)N1CCN(C)CC1 Show InChI InChI=1S/C25H34N6O4S/c1-4-20-22-24(31(28-20)17-8-6-7-9-17)26-23(27-25(22)32)19-16-18(10-11-21(19)35-5-2)36(33,34)30-14-12-29(3)13-15-30/h10-11,16-17H,4-9,12-15H2,1-3H3,(H,26,27,32) | 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 | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
BAYER HealthCare AG
Curated by ChEMBL
| Assay Description Inhibition of phosphodiesterase 5 |
Bioorg Med Chem Lett 15: 3900-7 (2005)
Article DOI: 10.1016/j.bmcl.2005.05.090 BindingDB Entry DOI: 10.7270/Q2XS5TWD |
More data for this Ligand-Target Pair | |