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BDBM50137650 CHEMBL3752885

SMILES: CN1CCN(CC1)c1nc(NCc2ccccc2)c2CCc3ccccc3-c2n1

InChI Key: InChIKey=PAICRLKZKAWHPK-UHFFFAOYSA-N

Data: 2 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50137650   
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 H1 receptor


(Homo sapiens (Human))
BDBM50137650
PNG
(CHEMBL3752885)
Show SMILES CN1CCN(CC1)c1nc(NCc2ccccc2)c2CCc3ccccc3-c2n1
Show InChI InChI=1S/C24H27N5/c1-28-13-15-29(16-14-28)24-26-22-20-10-6-5-9-19(20)11-12-21(22)23(27-24)25-17-18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,25,26,27)
PDB

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PC cid
PC sid
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Similars

PubMed
891n/an/an/an/an/an/an/an/a



Friedrich-Alexander-Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]mepyramine from human histamine 1 receptor expressed in Sf9 cell membranes by liquid scintillation counting


Bioorg Med Chem Lett 26: 292-300 (2016)


BindingDB Entry DOI: 10.7270/Q2Z03B0K
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50137650
PNG
(CHEMBL3752885)
Show SMILES CN1CCN(CC1)c1nc(NCc2ccccc2)c2CCc3ccccc3-c2n1
Show InChI InChI=1S/C24H27N5/c1-28-13-15-29(16-14-28)24-26-22-20-10-6-5-9-19(20)11-12-21(22)23(27-24)25-17-18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,25,26,27)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.45E+4n/an/an/an/an/an/an/an/a



Friedrich-Alexander-Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from human histamine 4 receptor expressed in Sf9 cell membranes by liquid scintillation counting


Bioorg Med Chem Lett 26: 292-300 (2016)


BindingDB Entry DOI: 10.7270/Q2Z03B0K
More data for this
Ligand-Target Pair