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BDBM50190098 CHEMBL214503::N-[2-chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-2-iodo-benzamide

SMILES: CN1CCN(CC1)C1=Nc2ccccc2N(NC(=O)c2ccccc2I)c2ccc(Cl)cc12

InChI Key: InChIKey=LSBNVDGHJXSXAB-UHFFFAOYSA-N

Data: 2 KI

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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 = 50190098   
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(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50190098
PNG
(CHEMBL214503 | N-[2-chloro-11-(4-methyl-piperazin-...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2N(NC(=O)c2ccccc2I)c2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C25H23ClIN5O/c1-30-12-14-31(15-13-30)24-19-16-17(26)10-11-22(19)32(23-9-5-4-8-21(23)28-24)29-25(33)18-6-2-3-7-20(18)27/h2-11,16H,12-15H2,1H3,(H,29,33)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute K15 2545

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH 23390 from dopamine D1 receptor expressed in CHO cells


Bioorg Med Chem Lett 16: 4548-53 (2006)

Checked by Author
Article DOI: 10.1016/j.bmcl.2006.06.034
BindingDB Entry DOI: 10.7270/Q2MG7P4R
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50190098
PNG
(CHEMBL214503 | N-[2-chloro-11-(4-methyl-piperazin-...)
Show SMILES CN1CCN(CC1)C1=Nc2ccccc2N(NC(=O)c2ccccc2I)c2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C25H23ClIN5O/c1-30-12-14-31(15-13-30)24-19-16-17(26)10-11-22(19)32(23-9-5-4-8-21(23)28-24)29-25(33)18-6-2-3-7-20(18)27/h2-11,16H,12-15H2,1H3,(H,29,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
231n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute K15 2545

Curated by ChEMBL


Assay Description
Displacement of [3H]methylspiperone from dopamine D2 receptor expressed in CHO cells


Bioorg Med Chem Lett 16: 4548-53 (2006)

Checked by Author
Article DOI: 10.1016/j.bmcl.2006.06.034
BindingDB Entry DOI: 10.7270/Q2MG7P4R
More data for this
Ligand-Target Pair