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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 274530   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Casein kinase I isoform delta


(Homo sapiens (Human))
BDBM274530
PNG
(N-(6-(1-(1-(2-amino-2- oxoethyl)piperidin-4-yl)-4-...)
Show SMILES Cc1nc(sc1C(=O)Nc1cn2nc(ccc2n1)-c1c(ncn1C1CCN(CC(N)=O)CC1)-c1ccc(F)cc1)-c1cccnc1
Show InChI InChI=1S/C32H29FN10O2S/c1-19-30(46-32(37-19)21-3-2-12-35-15-21)31(45)39-26-17-43-27(38-26)9-8-24(40-43)29-28(20-4-6-22(33)7-5-20)36-18-42(29)23-10-13-41(14-11-23)16-25(34)44/h2-9,12,15,17-18,23H,10-11,13-14,16H2,1H3,(H2,34,44)(H,39,45)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.0910n/an/an/an/a7.425



Bristol-Myers Squibb Company

US Patent


Assay Description
The kinase assay was performed in V-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme, subst...


US Patent US9556179 (2017)


BindingDB Entry DOI: 10.7270/Q2G73GR5
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM274530
PNG
(N-(6-(1-(1-(2-amino-2- oxoethyl)piperidin-4-yl)-4-...)
Show SMILES Cc1nc(sc1C(=O)Nc1cn2nc(ccc2n1)-c1c(ncn1C1CCN(CC(N)=O)CC1)-c1ccc(F)cc1)-c1cccnc1
Show InChI InChI=1S/C32H29FN10O2S/c1-19-30(46-32(37-19)21-3-2-12-35-15-21)31(45)39-26-17-43-27(38-26)9-8-24(40-43)29-28(20-4-6-22(33)7-5-20)36-18-42(29)23-10-13-41(14-11-23)16-25(34)44/h2-9,12,15,17-18,23H,10-11,13-14,16H2,1H3,(H2,34,44)(H,39,45)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.128n/an/an/an/a7.425



Bristol-Myers Squibb Company

US Patent


Assay Description
The kinase assay was performed in V-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme, subst...


US Patent US9556179 (2017)


BindingDB Entry DOI: 10.7270/Q2G73GR5
More data for this
Ligand-Target Pair