BindingDB logo
myBDB logout

null

SMILES: CCCN(CCN1CCN(Cc2cc3ccccc3[nH]2)CC1)Cc1ccc(Br)cc1

InChI Key: InChIKey=PHSMQRWSBVFISF-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 = 50121343   
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))
BDBM50121343
PNG
(CHEMBL3622103)
Show SMILES CCCN(CCN1CCN(Cc2cc3ccccc3[nH]2)CC1)Cc1ccc(Br)cc1
Show InChI InChI=1S/C25H33BrN4/c1-2-11-29(19-21-7-9-23(26)10-8-21)15-12-28-13-16-30(17-14-28)20-24-18-22-5-3-4-6-25(22)27-24/h3-10,18,27H,2,11-17,19-20H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
920n/an/an/an/an/an/an/an/a



Universit degli Studi di Milano

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2L receptor expressed in CHO cells


ACS Med Chem Lett 6: 882-7 (2015)


BindingDB Entry DOI: 10.7270/Q2708376
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50121343
PNG
(CHEMBL3622103)
Show SMILES CCCN(CCN1CCN(Cc2cc3ccccc3[nH]2)CC1)Cc1ccc(Br)cc1
Show InChI InChI=1S/C25H33BrN4/c1-2-11-29(19-21-7-9-23(26)10-8-21)15-12-28-13-16-30(17-14-28)20-24-18-22-5-3-4-6-25(22)27-24/h3-10,18,27H,2,11-17,19-20H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
930n/an/an/an/an/an/an/an/a



Universit degli Studi di Milano

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D3 receptor expressed in CHO cells


ACS Med Chem Lett 6: 882-7 (2015)


BindingDB Entry DOI: 10.7270/Q2708376
More data for this
Ligand-Target Pair