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BDBM203293 US10227340, Example 59::US9242975, 59

SMILES: CC(C)Nc1cc(Nc2ccc3ncsc3c2)ncc1-c1nc(cs1)C(=O)NCC1CCCO1

InChI Key: InChIKey=WDMDFWHUDRRESW-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 203293   
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
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM203293
PNG
(US10227340, Example 59 | US9242975, 59)
Show SMILES CC(C)Nc1cc(Nc2ccc3ncsc3c2)ncc1-c1nc(cs1)C(=O)NCC1CCCO1
Show InChI InChI=1S/C24H26N6O2S2/c1-14(2)28-19-9-22(29-15-5-6-18-21(8-15)34-13-27-18)25-11-17(19)24-30-20(12-33-24)23(31)26-10-16-4-3-7-32-16/h5-6,8-9,11-14,16H,3-4,7,10H2,1-2H3,(H,26,31)(H2,25,28,29)
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PC cid
PC sid
UniChem
US Patent
n/an/a 24n/an/an/an/an/an/a



Neuroscience



Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...


J Med Chem 51: 1719-29 (2008)


BindingDB Entry DOI: 10.7270/Q29C70Q8
More data for this
Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4


(Homo sapiens (Human))
BDBM203293
PNG
(US10227340, Example 59 | US9242975, 59)
Show SMILES CC(C)Nc1cc(Nc2ccc3ncsc3c2)ncc1-c1nc(cs1)C(=O)NCC1CCCO1
Show InChI InChI=1S/C24H26N6O2S2/c1-14(2)28-19-9-22(29-15-5-6-18-21(8-15)34-13-27-18)25-11-17(19)24-30-20(12-33-24)23(31)26-10-16-4-3-7-32-16/h5-6,8-9,11-14,16H,3-4,7,10H2,1-2H3,(H,26,31)(H2,25,28,29)
PDB
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UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 24n/an/an/an/a7.225



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substrates...


US Patent US9242975 (2016)


BindingDB Entry DOI: 10.7270/Q2MC8XVD
More data for this
Ligand-Target Pair