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BDBM426311 US10513524, Compound (P1)

SMILES: Fc1ccc(cc1)-c1ncc2n1nc(CN1CC(C1)Oc1ccncc1)[nH]c2=O

InChI Key: InChIKey=KCDCTXKHLQKROY-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 426311   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Dual specificity calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B


(Homo sapiens (Human))
BDBM426311
PNG
(US10513524, Compound (P1))
Show SMILES Fc1ccc(cc1)-c1ncc2n1nc(CN1CC(C1)Oc1ccncc1)[nH]c2=O
Show InChI InChI=1S/C20H17FN6O2/c21-14-3-1-13(2-4-14)19-23-9-17-20(28)24-18(25-27(17)19)12-26-10-16(11-26)29-15-5-7-22-8-6-15/h1-9,16H,10-12H2,(H,24,25,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 4.51E+4n/an/an/an/an/an/a



H. LUNDBECK A/S

US Patent


Assay Description
PDE1 assays were performed as follows: the assays was performed in 60 μL samples containing a fixed amount of the PDE1 enzym1 (sufficient to con...


US Patent US10513524 (2019)


BindingDB Entry DOI: 10.7270/Q2G44SNW
More data for this
Ligand-Target Pair
High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A


(Homo sapiens (Human))
BDBM426311
PNG
(US10513524, Compound (P1))
Show SMILES Fc1ccc(cc1)-c1ncc2n1nc(CN1CC(C1)Oc1ccncc1)[nH]c2=O
Show InChI InChI=1S/C20H17FN6O2/c21-14-3-1-13(2-4-14)19-23-9-17-20(28)24-18(25-27(17)19)12-26-10-16(11-26)29-15-5-7-22-8-6-15/h1-9,16H,10-12H2,(H,24,25,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 42n/an/an/an/an/an/a



H. LUNDBECK A/S

US Patent


Assay Description
A PDE9 assay may for example, be performed as follows: The assay is performed in 60 uL samples containing a fixed amount of the relevant PDE enzyme (...


US Patent US10513524 (2019)


BindingDB Entry DOI: 10.7270/Q2G44SNW
More data for this
Ligand-Target Pair