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BDBM50207043 CHEMBL3959964

SMILES: CN[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=GNYULWALHKFYNF-DNVCBOLYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   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 = 50207043   
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 6


(Homo sapiens (Human))
BDBM50207043
PNG
(CHEMBL3959964)
Show SMILES CN[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
10n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6R expressed in CHO cell membranes by radioligand binding assay


Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50207043
PNG
(CHEMBL3959964)
Show SMILES CN[C@@H]1[C@H](CCO)c2cc3n(ccc3cc12)S(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C19H20N2O3S/c1-20-19-15(8-10-22)16-12-18-13(11-17(16)19)7-9-21(18)25(23,24)14-5-3-2-4-6-14/h2-7,9,11-12,15,19-20,22H,8,10H2,1H3/t15-,19-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.26E+3n/an/an/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [3H]-methyl-spiperone from human dopamine D3 receptor expressed in CHO cell membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 25: 38-52 (2017)


Article DOI: 10.1016/j.bmc.2016.10.010
BindingDB Entry DOI: 10.7270/Q2VT1V3Q
More data for this
Ligand-Target Pair