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BDBM50409770 CHEMBL153067

SMILES: C(Cc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1)NCCc1ccccn1

InChI Key: InChIKey=WCRVDPZNPCPPJZ-UHFFFAOYSA-N

Data: 4 Kd

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 = 50409770   
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
Muscarinic acetylcholine receptor M3


(Cavia porcellus)
BDBM50409770
PNG
(CHEMBL153067)
Show SMILES C(Cc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1)NCCc1ccccn1
Show InChI InChI=1S/C27H30N4/c1-3-9-22(10-4-1)26(23-11-5-2-6-12-23)14-15-27-30-21-25(31-27)17-20-28-19-16-24-13-7-8-18-29-24/h1-13,18,21,26,28H,14-17,19-20H2,(H,30,31)
MMDB

Reactome pathway
KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 5.01E+3n/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Antagonistic activity for carbachol induced contractions in guinea pig ileum against Muscarinic acetylcholine receptor M3 in the presence of mepyrami...


J Med Chem 46: 5458-70 (2003)


Article DOI: 10.1021/jm0309147
BindingDB Entry DOI: 10.7270/Q2CN753N
More data for this
Ligand-Target Pair
HRH3


(GUINEA PIG)
BDBM50409770
PNG
(CHEMBL153067)
Show SMILES C(Cc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1)NCCc1ccccn1
Show InChI InChI=1S/C27H30N4/c1-3-9-22(10-4-1)26(23-11-5-2-6-12-23)14-15-27-30-21-25(31-27)17-20-28-19-16-24-13-7-8-18-29-24/h1-13,18,21,26,28H,14-17,19-20H2,(H,30,31)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a>501n/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Tetsed for Antagonistic activity at histamine H3 receptor in guinea pig ileal longitudinal muscle in the presence of mepyramine at a concentration of...


J Med Chem 46: 5458-70 (2003)


Article DOI: 10.1021/jm0309147
BindingDB Entry DOI: 10.7270/Q2CN753N
More data for this
Ligand-Target Pair
Histamine H1 receptor


(RAT)
BDBM50409770
PNG
(CHEMBL153067)
Show SMILES C(Cc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1)NCCc1ccccn1
Show InChI InChI=1S/C27H30N4/c1-3-9-22(10-4-1)26(23-11-5-2-6-12-23)14-15-27-30-21-25(31-27)17-20-28-19-16-24-13-7-8-18-29-24/h1-13,18,21,26,28H,14-17,19-20H2,(H,30,31)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 10.5n/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Apparent pA2 value of compound at 50 nM concentration of mepyramine in rat aorta


J Med Chem 46: 5458-70 (2003)


Article DOI: 10.1021/jm0309147
BindingDB Entry DOI: 10.7270/Q2CN753N
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Cavia porcellus (domestic guinea pig))
BDBM50409770
PNG
(CHEMBL153067)
Show SMILES C(Cc1cnc(CCC(c2ccccc2)c2ccccc2)[nH]1)NCCc1ccccn1
Show InChI InChI=1S/C27H30N4/c1-3-9-22(10-4-1)26(23-11-5-2-6-12-23)14-15-27-30-21-25(31-27)17-20-28-19-16-24-13-7-8-18-29-24/h1-13,18,21,26,28H,14-17,19-20H2,(H,30,31)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 4.37n/an/an/an/an/a



Freie Universit£t Berlin

Curated by ChEMBL


Assay Description
Apparent pA2 value of compound at 10 nM concentration of mepyramine in guinea pig ileum


J Med Chem 46: 5458-70 (2003)


Article DOI: 10.1021/jm0309147
BindingDB Entry DOI: 10.7270/Q2CN753N
More data for this
Ligand-Target Pair