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BDBM50218203 CHEMBL301409

SMILES: Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccs4)nc3)c2cc1Cl

InChI Key: InChIKey=WDLXFNDJOMMXFA-UHFFFAOYSA-N

Data: 3 KI

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 = 50218203   
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))
BDBM50218203
PNG
(CHEMBL301409)
Show SMILES Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccs4)nc3)c2cc1Cl
Show InChI InChI=1S/C19H17ClN4O2S/c1-12-8-13-4-6-24(16(13)9-15(12)20)19(25)23-14-2-3-17(22-10-14)26-11-18-21-5-7-27-18/h2-3,5,7-10H,4,6,11H2,1H3,(H,23,25)
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Article
PubMed
5n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned 5-hydroxytryptamine 2C receptor of HEK293 cells by [3H]mesulergine displacement.


Bioorg Med Chem Lett 10: 1867-70 (2000)


Article DOI: 10.1016/s0960-894x(00)00365-6
BindingDB Entry DOI: 10.7270/Q2SF2ZB2
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2B


(Homo sapiens (Human))
BDBM50218203
PNG
(CHEMBL301409)
Show SMILES Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccs4)nc3)c2cc1Cl
Show InChI InChI=1S/C19H17ClN4O2S/c1-12-8-13-4-6-24(16(13)9-15(12)20)19(25)23-14-2-3-17(22-10-14)26-11-18-21-5-7-27-18/h2-3,5,7-10H,4,6,11H2,1H3,(H,23,25)
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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
100n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned 5-hydroxytryptamine 2B receptor of HEK293 cells by [3H]5-HT displacement.


Bioorg Med Chem Lett 10: 1867-70 (2000)


Article DOI: 10.1016/s0960-894x(00)00365-6
BindingDB Entry DOI: 10.7270/Q2SF2ZB2
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Homo sapiens (Human))
BDBM50218203
PNG
(CHEMBL301409)
Show SMILES Cc1cc2CCN(C(=O)Nc3ccc(OCc4nccs4)nc3)c2cc1Cl
Show InChI InChI=1S/C19H17ClN4O2S/c1-12-8-13-4-6-24(16(13)9-15(12)20)19(25)23-14-2-3-17(22-10-14)26-11-18-21-5-7-27-18/h2-3,5,7-10H,4,6,11H2,1H3,(H,23,25)
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>794n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals Ltd

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned 5-hydroxytryptamine 2A receptor of HEK293 cells by [3H]ketanserin displacement.


Bioorg Med Chem Lett 10: 1867-70 (2000)


Article DOI: 10.1016/s0960-894x(00)00365-6
BindingDB Entry DOI: 10.7270/Q2SF2ZB2
More data for this
Ligand-Target Pair