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SMILES: CC(N)Cn1ccc2Cc3ccc(Br)cc3-c12

InChI Key: InChIKey=QJZZTZPYXNWSQS-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50471315   
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
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50471315
PNG
(CHEMBL320145)
Show SMILES CC(N)Cn1ccc2Cc3ccc(Br)cc3-c12
Show InChI InChI=1S/C14H15BrN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3
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PC cid
PC sid
UniChem
Article
PubMed
4n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 2C receptor using displacement of [3H]DOB


J Med Chem 40: 2762-9 (1997)


Article DOI: 10.1021/jm970030l
BindingDB Entry DOI: 10.7270/Q270845Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50471315
PNG
(CHEMBL320145)
Show SMILES CC(N)Cn1ccc2Cc3ccc(Br)cc3-c12
Show InChI InChI=1S/C14H15BrN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
100n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 2A receptor using displacement of [3H]5-HT


J Med Chem 40: 2762-9 (1997)


Article DOI: 10.1021/jm970030l
BindingDB Entry DOI: 10.7270/Q270845Q
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Rattus norvegicus (Rat))
BDBM50471315
PNG
(CHEMBL320145)
Show SMILES CC(N)Cn1ccc2Cc3ccc(Br)cc3-c12
Show InChI InChI=1S/C14H15BrN2/c1-9(16)8-17-5-4-11-6-10-2-3-12(15)7-13(10)14(11)17/h2-5,7,9H,6,8,16H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 2.51E+3n/an/an/an/a



F. Hoffmann-La Roche Inc

Curated by ChEMBL


Assay Description
Efficacy (pEC50) was evaluated for 5-HT2C receptor-mediated stimulation of IP3 formation in vitro in choroid plexus of the rat


J Med Chem 40: 2762-9 (1997)


Article DOI: 10.1021/jm970030l
BindingDB Entry DOI: 10.7270/Q270845Q
More data for this
Ligand-Target Pair