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BDBM22029 6-[(4,5-dichloro-2-methyl-1H-imidazol-1-yl)methyl]-5-{[(3R)-3-hydroxypyrrolidin-1-yl]carbonyl}-3-methyl-1-(2-methylpropyl)-1H,2H,3H,4H-thieno[2,3-d]pyrimidine-2,4-dione::Thieno[2,3-d]pyrimidine-2,4(1H,3H)-dione, 37

SMILES: CC(C)Cn1c2sc(Cn3c(C)nc(Cl)c3Cl)c(C(=O)N3CC[C@@H](O)C3)c2c(=O)n(C)c1=O

InChI Key: InChIKey=NEQSVLABUJREKW-GFCCVEGCSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 22029   
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
Monocarboxylate Transporter 1


(Homo sapiens (Human))
BDBM22029
PNG
(6-[(4,5-dichloro-2-methyl-1H-imidazol-1-yl)methyl]...)
Show SMILES CC(C)Cn1c2sc(Cn3c(C)nc(Cl)c3Cl)c(C(=O)N3CC[C@@H](O)C3)c2c(=O)n(C)c1=O |r|
Show InChI InChI=1S/C21H25Cl2N5O4S/c1-10(2)7-28-20-15(18(30)25(4)21(28)32)14(19(31)26-6-5-12(29)8-26)13(33-20)9-27-11(3)24-16(22)17(27)23/h10,12,29H,5-9H2,1-4H3/t12-/m1/s1
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
26 -10.2n/an/an/an/an/a7.422



AstraZeneca



Assay Description
A radioligand-binding assay was developed using scintillation proximity assay (SPA) technology. The wheat germ agglutinin SPA beads (Amersham) (0.2 m...


Bioorg Med Chem Lett 16: 2260-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.024
BindingDB Entry DOI: 10.7270/Q2C24TQK
More data for this
Ligand-Target Pair