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BDBM320288 US10174024, Example 5::tert-Butyl 4-[3-(dimethyl-1H-1,2,3-triazol-5-yl)-5-[(S)-oxan-4-yl(phenyl)methyl]-5H-pyrido[3,2-b]indol-8-yl]piperidine-1-carboxylate

SMILES: Cc1nnn(C)c1-c1cnc2c(c1)n([C@@H](C1CCOCC1)c1ccccc1)c1ccc(cc21)C1CCN(CC1)C(=O)OC(C)(C)C

InChI Key: InChIKey=UPKWCVQVJFIELR-PGUFJCEWSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 320288   
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
Bromodomain-containing protein 4


(Homo sapiens (Human))
BDBM320288
PNG
(US10174024, Example 5 | tert-Butyl 4-[3-(dimethyl-...)
Show SMILES Cc1nnn(C)c1-c1cnc2c(c1)n([C@@H](C1CCOCC1)c1ccccc1)c1ccc(cc21)C1CCN(CC1)C(=O)OC(C)(C)C |r|
Show InChI InChI=1S/C37H44N6O3/c1-24-34(41(5)40-39-24)29-22-32-33(38-23-29)30-21-28(25-13-17-42(18-14-25)36(44)46-37(2,3)4)11-12-31(30)43(32)35(26-9-7-6-8-10-26)27-15-19-45-20-16-27/h6-12,21-23,25,27,35H,13-20H2,1-5H3/t35-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<5n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The binding of compounds to bromodomain BRD4 (44-168), BRD4 (333-460), and BRD4 (1-477 or 44-460) was assessed using a time resolved fluorescent reso...


US Patent US10174024 (2019)


BindingDB Entry DOI: 10.7270/Q2319XZ1
More data for this
Ligand-Target Pair