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BDBM50403956 CHEMBL84293

SMILES: CCN(CC)CC1CC2N(O1)c1ccccc1Cc1ccccc21

InChI Key: InChIKey=UOSUONQDJGNZCQ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50403956   
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))
BDBM50403956
PNG
(CHEMBL84293)
Show SMILES CCN(CC)CC1CC2N(O1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C21H26N2O/c1-3-22(4-2)15-18-14-21-19-11-7-5-9-16(19)13-17-10-6-8-12-20(17)23(21)24-18/h5-12,18,21H,3-4,13-15H2,1-2H3
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Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Janssen-Cilag

Curated by ChEMBL


Assay Description
Binding affinity for human cloned Histamine H1 receptor expressed in CHO cells using [3H]pyrilamine as radioligand


Bioorg Med Chem Lett 12: 243-8 (2001)


Article DOI: 10.1016/s0960-894x(01)00721-1
BindingDB Entry DOI: 10.7270/Q23J3F4C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50403956
PNG
(CHEMBL84293)
Show SMILES CCN(CC)CC1CC2N(O1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C21H26N2O/c1-3-22(4-2)15-18-14-21-19-11-7-5-9-16(19)13-17-10-6-8-12-20(17)23(21)24-18/h5-12,18,21H,3-4,13-15H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Janssen-Cilag

Curated by ChEMBL


Assay Description
Binding affinity for human cloned 5-hydroxytryptamine 2C receptor expressed in CHO cells using [3H]mesulergine as radioligand


Bioorg Med Chem Lett 12: 243-8 (2001)


Article DOI: 10.1016/s0960-894x(01)00721-1
BindingDB Entry DOI: 10.7270/Q23J3F4C
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50403956
PNG
(CHEMBL84293)
Show SMILES CCN(CC)CC1CC2N(O1)c1ccccc1Cc1ccccc21
Show InChI InChI=1S/C21H26N2O/c1-3-22(4-2)15-18-14-21-19-11-7-5-9-16(19)13-17-10-6-8-12-20(17)23(21)24-18/h5-12,18,21H,3-4,13-15H2,1-2H3
Reactome pathway
KEGG

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 43n/an/an/an/an/an/a



Janssen-Cilag

Curated by ChEMBL


Assay Description
Binding affinity for human cloned 5-hydroxytryptamine 2A receptor expressed in L929 cells using [125I]R91150 as radioligand


Bioorg Med Chem Lett 12: 243-8 (2001)


Article DOI: 10.1016/s0960-894x(01)00721-1
BindingDB Entry DOI: 10.7270/Q23J3F4C
More data for this
Ligand-Target Pair