BindingDB logo
myBDB logout

BDBM50224976 CHEMBL2096687

SMILES: Cl.Cl.Clc1ccc(cc1Cl)C1CC(N2CCN(C\C=C\c3ccccc3)CC2)c2ccccc12

InChI Key: InChIKey=XFCBHDDFLGMROS-SWSRPJROSA-N

Data: 2 IC50

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 = 50224976   
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
Dopamine receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50224976
PNG
(CHEMBL2096687)
Show SMILES Cl.Cl.Clc1ccc(cc1Cl)C1CC(N2CCN(C\C=C\c3ccccc3)CC2)c2ccccc12
Show InChI InChI=1S/C28H28Cl2N2.2ClH/c29-26-13-12-22(19-27(26)30)25-20-28(24-11-5-4-10-23(24)25)32-17-15-31(16-18-32)14-6-9-21-7-2-1-3-8-21;;/h1-13,19,25,28H,14-18,20H2;2*1H/b9-6+;;
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Effect on synaptosomal uptake inhibition of Dopamine receptor


J Med Chem 26: 935-47 (1983)


BindingDB Entry DOI: 10.7270/Q2JH3MR6
More data for this
Ligand-Target Pair
Dopamine receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50224976
PNG
(CHEMBL2096687)
Show SMILES Cl.Cl.Clc1ccc(cc1Cl)C1CC(N2CCN(C\C=C\c3ccccc3)CC2)c2ccccc12
Show InChI InChI=1S/C28H28Cl2N2.2ClH/c29-26-13-12-22(19-27(26)30)25-20-28(24-11-5-4-10-23(24)25)32-17-15-31(16-18-32)14-6-9-21-7-2-1-3-8-21;;/h1-13,19,25,28H,14-18,20H2;2*1H/b9-6+;;
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 35n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Effect on synaptosomal uptake inhibition of Dopamine receptor


J Med Chem 26: 935-47 (1983)


BindingDB Entry DOI: 10.7270/Q2JH3MR6
More data for this
Ligand-Target Pair