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BDBM50070829 CHEMBL3409240

SMILES: Fc1cccc(Cn2ccc3c(cccc23)N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1

InChI Key: InChIKey=RUARTZMULZTFHQ-UHFFFAOYSA-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 = 50070829   
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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50070829
PNG
(CHEMBL3409240)
Show SMILES Fc1cccc(Cn2ccc3c(cccc23)N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1
Show InChI InChI=1S/C32H35FN4O2/c33-26-6-3-5-24(21-26)23-37-15-13-28-30(7-4-8-31(28)37)36-18-16-35(17-19-36)14-1-2-20-39-27-11-9-25-10-12-32(38)34-29(25)22-27/h3-9,11,13,15,21-22H,1-2,10,12,14,16-20,23H2,(H,34,38)
PDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
6.10n/an/an/an/an/an/an/an/a



Jagiellonian University Collegium Medicum

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylspiperone from human recombinant dopamine D2 receptor expressed in CHOK1 cells incubated for 60 mins by scintillation cou...


Eur J Med Chem 92: 221-35 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.045
BindingDB Entry DOI: 10.7270/Q2Q241XV
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50070829
PNG
(CHEMBL3409240)
Show SMILES Fc1cccc(Cn2ccc3c(cccc23)N2CCN(CCCCOc3ccc4CCC(=O)Nc4c3)CC2)c1
Show InChI InChI=1S/C32H35FN4O2/c33-26-6-3-5-24(21-26)23-37-15-13-28-30(7-4-8-31(28)37)36-18-16-35(17-19-36)14-1-2-20-39-27-11-9-25-10-12-32(38)34-29(25)22-27/h3-9,11,13,15,21-22H,1-2,10,12,14,16-20,23H2,(H,34,38)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
20n/an/an/an/an/an/an/an/a



Jagiellonian University Collegium Medicum

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human recombinant 5-HT6 receptor expressed in HEK-293 cells incubated for 60 mins by scintillation counting method


Eur J Med Chem 92: 221-35 (2015)


Article DOI: 10.1016/j.ejmech.2014.12.045
BindingDB Entry DOI: 10.7270/Q2Q241XV
More data for this
Ligand-Target Pair