BindingDB logo
myBDB logout

null

SMILES: Oc1ccc2CCC(Cc2c1)N(CCCCNC(=O)c1ccccc1)CCCN1CCN(CC1)c1ccccc1

InChI Key: InChIKey=HYAIONDADCANQM-UHFFFAOYSA-N

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 2 hits for monomerid = 50109924   
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))
BDBM50109924
PNG
(CHEMBL156816 | N-(4-{(7-Hydroxy-1,2,3,4-tetrahydro...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCNC(=O)c1ccccc1)CCCN1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C34H44N4O2/c39-33-17-15-28-14-16-32(26-30(28)27-33)37(20-8-7-18-35-34(40)29-10-3-1-4-11-29)21-9-19-36-22-24-38(25-23-36)31-12-5-2-6-13-31/h1-6,10-13,15,17,27,32,39H,7-9,14,16,18-26H2,(H,35,40)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
756n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Tested for the binding constant against cloned human Dopamine receptor D3 in HEK cells by displacing [3H]-spiperone


Bioorg Med Chem Lett 12: 619-22 (2002)


BindingDB Entry DOI: 10.7270/Q25X287P
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50109924
PNG
(CHEMBL156816 | N-(4-{(7-Hydroxy-1,2,3,4-tetrahydro...)
Show SMILES Oc1ccc2CCC(Cc2c1)N(CCCCNC(=O)c1ccccc1)CCCN1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C34H44N4O2/c39-33-17-15-28-14-16-32(26-30(28)27-33)37(20-8-7-18-35-34(40)29-10-3-1-4-11-29)21-9-19-36-22-24-38(25-23-36)31-12-5-2-6-13-31/h1-6,10-13,15,17,27,32,39H,7-9,14,16,18-26H2,(H,35,40)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
782n/an/an/an/an/an/an/an/a



Wayne State University

Curated by ChEMBL


Assay Description
Tested for the binding constant against cloned human Dopamine receptor D2L in HEK cells by displacing [3H]-spiperone


Bioorg Med Chem Lett 12: 619-22 (2002)


BindingDB Entry DOI: 10.7270/Q25X287P
More data for this
Ligand-Target Pair