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BDBM50190058 CHEMBL213466::N-[2,8-dichloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-2,3,4,5-tetrafluoro-benzamide

SMILES: CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2cc(F)c(F)c(F)c2F)c2ccc(Cl)cc12

InChI Key: InChIKey=XODYFOOKKAGIOI-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50190058   
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))
BDBM50190058
PNG
(CHEMBL213466 | N-[2,8-dichloro-11-(4-methyl-pipera...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2cc(F)c(F)c(F)c2F)c2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C25H19Cl2F4N5O/c1-34-6-8-35(9-7-34)24-15-10-13(26)2-4-19(15)36(20-5-3-14(27)11-18(20)32-24)33-25(37)16-12-17(28)22(30)23(31)21(16)29/h2-5,10-12H,6-9H2,1H3,(H,33,37)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
98n/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))
BDBM50190058
PNG
(CHEMBL213466 | N-[2,8-dichloro-11-(4-methyl-pipera...)
Show SMILES CN1CCN(CC1)C1=Nc2cc(Cl)ccc2N(NC(=O)c2cc(F)c(F)c(F)c2F)c2ccc(Cl)cc12 |t:8|
Show InChI InChI=1S/C25H19Cl2F4N5O/c1-34-6-8-35(9-7-34)24-15-10-13(26)2-4-19(15)36(20-5-3-14(27)11-18(20)32-24)33-25(37)16-12-17(28)22(30)23(31)21(16)29/h2-5,10-12H,6-9H2,1H3,(H,33,37)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
270n/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