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BDBM50274654 2-Methyl-3-[4-([3-(1-pyrrolidinyl)cyclopentyl]oxy)phenyl]-4(3H)-quinazolinone::CHEMBL484740

SMILES: Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1

InChI Key: InChIKey=RWNXKETUEWVUIP-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50274654   
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
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50274654
PNG
(2-Methyl-3-[4-([3-(1-pyrrolidinyl)cyclopentyl]oxy)...)
Show SMILES Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1
Show InChI InChI=1S/C24H27N3O2/c1-17-25-23-7-3-2-6-22(23)24(28)27(17)18-8-11-20(12-9-18)29-21-13-10-19(16-21)26-14-4-5-15-26/h2-3,6-9,11-12,19,21H,4-5,10,13-16H2,1H3
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Article
PubMed
n/an/a 3.40n/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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50274654
PNG
(2-Methyl-3-[4-([3-(1-pyrrolidinyl)cyclopentyl]oxy)...)
Show SMILES Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1
Show InChI InChI=1S/C24H27N3O2/c1-17-25-23-7-3-2-6-22(23)24(28)27(17)18-8-11-20(12-9-18)29-21-13-10-19(16-21)26-14-4-5-15-26/h2-3,6-9,11-12,19,21H,4-5,10,13-16H2,1H3
PDB
MMDB

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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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50274654
PNG
(2-Methyl-3-[4-([3-(1-pyrrolidinyl)cyclopentyl]oxy)...)
Show SMILES Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1
Show InChI InChI=1S/C24H27N3O2/c1-17-25-23-7-3-2-6-22(23)24(28)27(17)18-8-11-20(12-9-18)29-21-13-10-19(16-21)26-14-4-5-15-26/h2-3,6-9,11-12,19,21H,4-5,10,13-16H2,1H3
PDB
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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))
BDBM50274654
PNG
(2-Methyl-3-[4-([3-(1-pyrrolidinyl)cyclopentyl]oxy)...)
Show SMILES Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1
Show InChI InChI=1S/C24H27N3O2/c1-17-25-23-7-3-2-6-22(23)24(28)27(17)18-8-11-20(12-9-18)29-21-13-10-19(16-21)26-14-4-5-15-26/h2-3,6-9,11-12,19,21H,4-5,10,13-16H2,1H3
Reactome pathway
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PC sid
UniChem

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Article
PubMed
n/an/a 8.60n/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