BDBM50193579 7-benzyl-9-methyl-2-phenyl-4-propyl-7H-3,3a,5,7,8-pentaaza-cyclopenta[a]naphthalen-6-one::CHEMBL438451
SMILES: CCCc1nc2c(c(C)nn(Cc3ccccc3)c2=O)c2cc(nn12)-c1ccccc1
InChI Key: InChIKey=UEMKDTSBXWIJFQ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50193579 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)) | BDBM50193579
(7-benzyl-9-methyl-2-phenyl-4-propyl-7H-3,3a,5,7,8-...)Show SMILES CCCc1nc2c(c(C)nn(Cc3ccccc3)c2=O)c2cc(nn12)-c1ccccc1 Show InChI InChI=1S/C25H23N5O/c1-3-10-22-26-24-23(21-15-20(28-30(21)22)19-13-8-5-9-14-19)17(2)27-29(25(24)31)16-18-11-6-4-7-12-18/h4-9,11-15H,3,10,16H2,1-2H3 | 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 |
Università di Firenze
Curated by ChEMBL
| Assay Description Inhibition of PDE5 |
J Med Chem 49: 5363-71 (2006)
Article DOI: 10.1021/jm060265+ BindingDB Entry DOI: 10.7270/Q2GB23PC |
More data for this Ligand-Target Pair | |
Phosphodiesterase 6
(Homo sapiens (Human)) | BDBM50193579
(7-benzyl-9-methyl-2-phenyl-4-propyl-7H-3,3a,5,7,8-...)Show SMILES CCCc1nc2c(c(C)nn(Cc3ccccc3)c2=O)c2cc(nn12)-c1ccccc1 Show InChI InChI=1S/C25H23N5O/c1-3-10-22-26-24-23(21-15-20(28-30(21)22)19-13-8-5-9-14-19)17(2)27-29(25(24)31)16-18-11-6-4-7-12-18/h4-9,11-15H,3,10,16H2,1-2H3 | PDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 610 | n/a | n/a | n/a | n/a | n/a | n/a |
Università di Firenze
Curated by ChEMBL
| Assay Description Inhibition of PDE6 |
J Med Chem 49: 5363-71 (2006)
Article DOI: 10.1021/jm060265+ BindingDB Entry DOI: 10.7270/Q2GB23PC |
More data for this Ligand-Target Pair | |