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BDBM50274039 3-(4-[(1-Cyclobutyl-4-piperidinyl)oxy]phenyl)-7-methoxy-2-methyl-4(3H)-quinazolinone::CHEMBL485388

SMILES: COc1ccc2c(c1)nc(C)n(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)c2=O

InChI Key: InChIKey=KRBPBDKNTPVHRB-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50274039   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50274039
PNG
(3-(4-[(1-Cyclobutyl-4-piperidinyl)oxy]phenyl)-7-me...)
Show SMILES COc1ccc2c(c1)nc(C)n(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)c2=O
Show InChI InChI=1S/C25H29N3O3/c1-17-26-24-16-22(30-2)10-11-23(24)25(29)28(17)19-6-8-20(9-7-19)31-21-12-14-27(15-13-21)18-4-3-5-18/h6-11,16,18,21H,3-5,12-15H2,1-2H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human ERG in HEK293 cells assessed as inhibition of [35S]N-[(4R)-1'-[(2R)-6-cyano-1,2,3,4-tetrahydro-2-naphthalenyl]-3,4-dihyd...


J Med Chem 51: 6889-901 (2008)


Article DOI: 10.1021/jm800569w
BindingDB Entry DOI: 10.7270/Q27P8Z60
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50274039
PNG
(3-(4-[(1-Cyclobutyl-4-piperidinyl)oxy]phenyl)-7-me...)
Show SMILES COc1ccc2c(c1)nc(C)n(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)c2=O
Show InChI InChI=1S/C25H29N3O3/c1-17-26-24-16-22(30-2)10-11-23(24)25(29)28(17)19-6-8-20(9-7-19)31-21-12-14-27(15-13-21)18-4-3-5-18/h6-11,16,18,21H,3-5,12-15H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned histamine H3 receptor expressed in CHO-K1 cells assessed as inhibition of R-alpha-methylhistamine-induced [35S]GT...


J Med Chem 51: 6889-901 (2008)


Article DOI: 10.1021/jm800569w
BindingDB Entry DOI: 10.7270/Q27P8Z60
More data for this
Ligand-Target Pair