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BDBM274443 N-(6-(4-(4-fluorophenyl)-1-(1-(isoxazol- 3-ylmethyl)piperidin-4-yl)-1H-imidazol- 5-yl)imidazo[1,2-b]pyridazin-2- yl)isonicotinamide::US9556179, Compound 12

SMILES: Fc1ccc(cc1)-c1ncn(C2CCN(Cc3ccon3)CC2)c1-c1ccc2nc(NC(=O)c3ccnc(F)c3)cn2n1

InChI Key: InChIKey=NUNHEPZIMSCKCE-UHFFFAOYSA-N

Data: 2 IC50

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 = 274443   
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))
BDBM274443
PNG
(N-(6-(4-(4-fluorophenyl)-1-(1-(isoxazol- 3-ylmethy...)
Show SMILES Fc1ccc(cc1)-c1ncn(C2CCN(Cc3ccon3)CC2)c1-c1ccc2nc(NC(=O)c3ccnc(F)c3)cn2n1
Show InChI InChI=1S/C30H25F2N9O2/c31-21-3-1-19(2-4-21)28-29(40(18-34-28)23-8-12-39(13-9-23)16-22-10-14-43-38-22)24-5-6-27-35-26(17-41(27)37-24)36-30(42)20-7-11-33-25(32)15-20/h1-7,10-11,14-15,17-18,23H,8-9,12-13,16H2,(H,36,42)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.847n/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))
BDBM274443
PNG
(N-(6-(4-(4-fluorophenyl)-1-(1-(isoxazol- 3-ylmethy...)
Show SMILES Fc1ccc(cc1)-c1ncn(C2CCN(Cc3ccon3)CC2)c1-c1ccc2nc(NC(=O)c3ccnc(F)c3)cn2n1
Show InChI InChI=1S/C30H25F2N9O2/c31-21-3-1-19(2-4-21)28-29(40(18-34-28)23-8-12-39(13-9-23)16-22-10-14-43-38-22)24-5-6-27-35-26(17-41(27)37-24)36-30(42)20-7-11-33-25(32)15-20/h1-7,10-11,14-15,17-18,23H,8-9,12-13,16H2,(H,36,42)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.283n/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