Reaction Details | |||
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Target | cGMP-specific 3',5'-cyclic phosphodiesterase | ||
Ligand | BDBM50300952 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_597959 (CHEMBL1042744) | ||
IC50 | 0.320000±n/a nM | ||
Citation | Hughes, RO; Walker, JK; Rogier, DJ; Heasley, SE; Blevis-Bal, RM; Benson, AG; Jacobsen, EJ; Cubbage, JW; Fobian, YM; Owen, DR; Freskos, JN; Molyneaux, JM; Brown, DL; Acker, BA; Maddux, TM; Tollefson, MB; Moon, JB; Mischke, BV; Rumsey, JM; Zheng, Y; MacInnes, A; Bond, BR; Yu, Y Optimization of the aminopyridopyrazinones class of PDE5 inhibitors: discovery of 3-[(trans-4-hydroxycyclohexyl)amino]-7-(6-methoxypyridin-3-yl)-1-(2-propoxyethyl)pyrido[3,4-b]pyrazin-2(1H)-one. Bioorg Med Chem Lett19:5209-13 (2009) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
cGMP-specific 3',5'-cyclic phosphodiesterase | |||
Name: | cGMP-specific 3',5'-cyclic phosphodiesterase | ||
Synonyms: | 3',5'-cyclic phosphodiesterase | CGB-PDE | PDE5 | PDE5A | PDE5A_HUMAN | Phosphodiesterase 2 and 5 (PDE2 and PDE5) | Phosphodiesterase 5 (PDE5) | Phosphodiesterase 5A | Phosphodiesterase 5A (PDE5A) | cGMP-binding cGMP-specific phosphodiesterase | cGMP-specific 3',5'-cyclic phosphodiesterase | ||
Type: | Protein | ||
Mol. Mass.: | 99975.83 | ||
Organism: | Homo sapiens (Human) | ||
Description: | O76074 | ||
Residue: | 875 | ||
Sequence: |
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BDBM50300952 | |||
n/a | |||
Name | BDBM50300952 | ||
Synonyms: | 3-(trans-4-hydroxycyclohexylamino)-7-(6-methoxypyridin-3-yl)-1-(2-propoxyethyl)pyrido[2,3-b]pyrazin-2(1H)-one | CHEMBL566820 | ||
Type | Small organic molecule | ||
Emp. Form. | C24H31N5O4 | ||
Mol. Mass. | 453.534 | ||
SMILES | CCCOCCn1c2cc(cnc2nc(N[C@H]2CC[C@H](O)CC2)c1=O)-c1ccc(OC)nc1 |r,wU:16.16,wD:19.20,(3.98,.08,;2.65,-.69,;2.65,-2.23,;1.32,-3,;1.32,-4.54,;-.02,-5.31,;-.02,-6.85,;1.31,-7.63,;2.64,-6.86,;3.96,-7.62,;3.97,-9.17,;2.64,-9.93,;1.31,-9.17,;-.02,-9.93,;-1.36,-9.16,;-2.7,-9.93,;-4.03,-9.15,;-5.37,-9.93,;-6.7,-9.15,;-6.69,-7.6,;-8.02,-6.82,;-5.35,-6.84,;-4.03,-7.62,;-1.35,-7.63,;-2.68,-6.86,;5.29,-6.85,;6.63,-7.62,;7.96,-6.84,;7.95,-5.3,;9.28,-4.53,;10.62,-5.29,;6.61,-4.54,;5.28,-5.31,)| | ||
Structure |