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BDBM236061 US9365562, 99

SMILES: Cc1nc(cc(n1)-c1ccc(Cl)cn1)N1CC(C1)c1nc2ccccc2n1C

InChI Key: InChIKey=VJRHPRNZDBNXNZ-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 236061   
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
Phosphodiesterase 10A (PDE10A2)


(Homo sapiens (Human))
BDBM236061
PNG
(US9365562, 99)
Show SMILES Cc1nc(cc(n1)-c1ccc(Cl)cn1)N1CC(C1)c1nc2ccccc2n1C
Show InChI InChI=1S/C21H19ClN6/c1-13-24-18(16-8-7-15(22)10-23-16)9-20(25-13)28-11-14(12-28)21-26-17-5-3-4-6-19(17)27(21)2/h3-10,14H,11-12H2,1-2H3
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
1.10 -12.2n/an/an/an/an/a7.225



Merck Sharp & Dohme Corp

US Patent


Assay Description
The fluorescence polarization assay for cyclic nucleotide phosphodiesterases was performed using an IMAP® FP kit supplied by Molecular Devices, S...


US Patent US9365562 (2016)


BindingDB Entry DOI: 10.7270/Q2ST7NQZ
More data for this
Ligand-Target Pair