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BDBM50400598 CHEMBL2206270

SMILES: CCCN(CCCCN(CCC)[C@H]1CCc2c(O)cccc2C1)[C@H]1CCc2c(O)cccc2C1

InChI Key: InChIKey=IXVCYXLRBYFANX-UIOOFZCWSA-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 = 50400598   
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


(Rattus norvegicus (Rat))
BDBM50400598
PNG
(CHEMBL2206270)
Show SMILES CCCN(CCCCN(CCC)[C@H]1CCc2c(O)cccc2C1)[C@H]1CCc2c(O)cccc2C1 |r|
Show InChI InChI=1S/C30H44N2O2/c1-3-17-31(25-13-15-27-23(21-25)9-7-11-29(27)33)19-5-6-20-32(18-4-2)26-14-16-28-24(22-26)10-8-12-30(28)34/h7-12,25-26,33-34H,3-6,13-22H2,1-2H3/t25-,26-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from rat cloned dopamine D3 receptor expressed in HEK-293 cells by competition binding assay


ACS Med Chem Lett 3: 991-996 (2012)


Article DOI: 10.1021/ml3002117
BindingDB Entry DOI: 10.7270/Q26M3804
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50400598
PNG
(CHEMBL2206270)
Show SMILES CCCN(CCCCN(CCC)[C@H]1CCc2c(O)cccc2C1)[C@H]1CCc2c(O)cccc2C1 |r|
Show InChI InChI=1S/C30H44N2O2/c1-3-17-31(25-13-15-27-23(21-25)9-7-11-29(27)33)19-5-6-20-32(18-4-2)26-14-16-28-24(22-26)10-8-12-30(28)34/h7-12,25-26,33-34H,3-6,13-22H2,1-2H3/t25-,26-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
70n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from rat cloned dopamine D2L receptor expressed in HEK-293 cells by competition binding assay


ACS Med Chem Lett 3: 991-996 (2012)


Article DOI: 10.1021/ml3002117
BindingDB Entry DOI: 10.7270/Q26M3804
More data for this
Ligand-Target Pair