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BDBM50190233 CHEMBL214407::N-[8-chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-2-phenoxy-benzamide

SMILES: CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2ccccc2Oc2ccccc2)c2ccccc12

InChI Key: InChIKey=IOOYLGJHCPSDIU-UHFFFAOYSA-N

Data: 2 KI

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 = 50190233   
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))
BDBM50190233
PNG
(CHEMBL214407 | N-[8-chloro-11-(4-methyl-piperazin-...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2ccccc2Oc2ccccc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H28ClN5O2/c1-35-17-19-36(20-18-35)30-24-11-5-7-13-27(24)37(28-16-15-22(32)21-26(28)33-30)34-31(38)25-12-6-8-14-29(25)39-23-9-3-2-4-10-23/h2-16,21H,17-20H2,1H3,(H,34,38)
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
51n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 4543-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.022
BindingDB Entry DOI: 10.7270/Q2GT5MSW
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50190233
PNG
(CHEMBL214407 | N-[8-chloro-11-(4-methyl-piperazin-...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2ccccc2Oc2ccccc2)c2ccccc12 |t:8|
Show InChI InChI=1S/C31H28ClN5O2/c1-35-17-19-36(20-18-35)30-24-11-5-7-13-27(24)37(28-16-15-22(32)21-26(28)33-30)34-31(38)25-12-6-8-14-29(25)39-23-9-3-2-4-10-23/h2-16,21H,17-20H2,1H3,(H,34,38)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
431n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


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


Bioorg Med Chem Lett 16: 4543-7 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.022
BindingDB Entry DOI: 10.7270/Q2GT5MSW
More data for this
Ligand-Target Pair