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SMILES: COc1ccccc1N1CCN(CCCCCc2cn(nn2)-c2ccc(cc2)N(C)C)CC1

InChI Key: InChIKey=JEFLKZKNAVDDCN-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 2 hits for monomerid = 50042772   
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(3) dopamine receptor


(Homo sapiens (Human))
BDBM50042772
PNG
(CHEMBL3353911)
Show SMILES COc1ccccc1N1CCN(CCCCCc2cn(nn2)-c2ccc(cc2)N(C)C)CC1
Show InChI InChI=1S/C26H36N6O/c1-29(2)23-12-14-24(15-13-23)32-21-22(27-28-32)9-5-4-8-16-30-17-19-31(20-18-30)25-10-6-7-11-26(25)33-3/h6-7,10-15,21H,4-5,8-9,16-20H2,1-3H3
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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.70n/an/an/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Displacement of of [125I]-IABN from human D3 receptor expressed in HEK293 cell membranes after 60 mins by filtration binding assay


Bioorg Med Chem Lett 25: 519-23 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.023
BindingDB Entry DOI: 10.7270/Q27W6DS9
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50042772
PNG
(CHEMBL3353911)
Show SMILES COc1ccccc1N1CCN(CCCCCc2cn(nn2)-c2ccc(cc2)N(C)C)CC1
Show InChI InChI=1S/C26H36N6O/c1-29(2)23-12-14-24(15-13-23)32-21-22(27-28-32)9-5-4-8-16-30-17-19-31(20-18-30)25-10-6-7-11-26(25)33-3/h6-7,10-15,21H,4-5,8-9,16-20H2,1-3H3
PDB

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UniProtKB/SwissProt

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antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
63n/an/an/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Displacement of of [125I]-IABN from human D2 long receptor expressed in HEK293 cell membranes after 60 mins by filtration binding assay


Bioorg Med Chem Lett 25: 519-23 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.023
BindingDB Entry DOI: 10.7270/Q27W6DS9
More data for this
Ligand-Target Pair