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SMILES: Cc1nc(cs1)-c1ccc(NC(=O)N2CCn3nc(c(C(N)=O)c3C2)-c2cccc(Cl)c2)cc1

InChI Key: InChIKey=CXFBJOVPDWYDAA-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 302816   
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
Casein kinase I isoform delta


(Homo sapiens (Human))
BDBM302816
PNG
(2-(3-Chlorophenyl)-N5- (4-(2-methylthiazol-4- yl)p...)
Show SMILES Cc1nc(cs1)-c1ccc(NC(=O)N2CCn3nc(c(C(N)=O)c3C2)-c2cccc(Cl)c2)cc1 |$;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|
Show InChI InChI=1S/C24H21ClN6O2S/c1-14-27-19(13-34-14)15-5-7-18(8-6-15)28-24(33)30-9-10-31-20(12-30)21(23(26)32)22(29-31)16-3-2-4-17(25)11-16/h2-8,11,13H,9-10,12H2,1H3,(H2,26,32)(H,28,33)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



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 US9598423 (2017)


BindingDB Entry DOI: 10.7270/Q2FJ2JT9
More data for this
Ligand-Target Pair
Casein kinase I isoform epsilon


(Homo sapiens (Human))
BDBM302816
PNG
(2-(3-Chlorophenyl)-N5- (4-(2-methylthiazol-4- yl)p...)
Show SMILES Cc1nc(cs1)-c1ccc(NC(=O)N2CCn3nc(c(C(N)=O)c3C2)-c2cccc(Cl)c2)cc1 |$;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;$|
Show InChI InChI=1S/C24H21ClN6O2S/c1-14-27-19(13-34-14)15-5-7-18(8-6-15)28-24(33)30-9-10-31-20(12-30)21(23(26)32)22(29-31)16-3-2-4-17(25)11-16/h2-8,11,13H,9-10,12H2,1H3,(H2,26,32)(H,28,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/an/an/an/an/an/a



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 US9598423 (2017)


BindingDB Entry DOI: 10.7270/Q2FJ2JT9
More data for this
Ligand-Target Pair