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BDBM99010 US8497265, 466::US8497265, 470

SMILES: COc1ncccc1-c1cnc(nc1OC1CN(C1)c1ccc2ccccc2n1)N1CCC(CO)CC1

InChI Key: InChIKey=RLMWPIZMMMUVAL-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 = 99010   
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 Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM99010
PNG
(US8497265, 466 | US8497265, 470)
Show SMILES COc1ncccc1-c1cnc(nc1OC1CN(C1)c1ccc2ccccc2n1)N1CCC(CO)CC1
Show InChI InChI=1S/C28H30N6O3/c1-36-26-22(6-4-12-29-26)23-15-30-28(33-13-10-19(18-35)11-14-33)32-27(23)37-21-16-34(17-21)25-9-8-20-5-2-3-7-24(20)31-25/h2-9,12,15,19,21,35H,10-11,13-14,16-18H2,1H3
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 3.10n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
Enzyme activity: An IMAP TR-FRET assay was used to analyze the enzyme activity (Molecular Devices Corp., Sunnyvale, Calif).


US Patent US8497265 (2013)


BindingDB Entry DOI: 10.7270/Q2VD6X39
More data for this
Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A)


(Rattus norvegicus (rat))
BDBM99010
PNG
(US8497265, 466 | US8497265, 470)
Show SMILES COc1ncccc1-c1cnc(nc1OC1CN(C1)c1ccc2ccccc2n1)N1CCC(CO)CC1
Show InChI InChI=1S/C28H30N6O3/c1-36-26-22(6-4-12-29-26)23-15-30-28(33-13-10-19(18-35)11-14-33)32-27(23)37-21-16-34(17-21)25-9-8-20-5-2-3-7-24(20)31-25/h2-9,12,15,19,21,35H,10-11,13-14,16-18H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.600n/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
Enzyme activity: An IMAP TR-FRET assay was used to analyze the enzyme activity (Molecular Devices Corp., Sunnyvale, Calif).


US Patent US8497265 (2013)


BindingDB Entry DOI: 10.7270/Q2VD6X39
More data for this
Ligand-Target Pair