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BDBM180935 US9133187, I-15

SMILES: CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NC([C@H]1CCCN1)c1ccc(c(F)c1)C(F)(F)F

InChI Key: InChIKey=VXDYYJPLOFIVKA-QSVWIEALSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 180935   
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
Mitogen-activated protein kinase 1


(Homo sapiens (Human))
BDBM180935
PNG
(US9133187, I-15)
Show SMILES CC(C)Nc1ncc2CCN(Cc2n1)C(=O)NC([C@H]1CCCN1)c1ccc(c(F)c1)C(F)(F)F |r|
Show InChI InChI=1S/C23H28F4N6O/c1-13(2)30-21-29-11-15-7-9-33(12-19(15)31-21)22(34)32-20(18-4-3-8-28-18)14-5-6-16(17(24)10-14)23(25,26)27/h5-6,10-11,13,18,20,28H,3-4,7-9,12H2,1-2H3,(H,32,34)(H,29,30,31)/t18-,20?/m1/s1
PDB
MMDB

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UniProtKB/SwissProt
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PC cid
PC sid
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Similars

US Patent
n/an/a 1.10n/an/an/an/a7.3n/a



ARRAY BIOPHARMA INC.; GENENTECH, INC.

US Patent


Assay Description
Compounds were tested in an enzymatic assay using human ERK-2 (Mitogen Activated Kinase 1), recombinantly expressed as an n-terminal 6-His fusion pro...


US Patent US9133187 (2015)


BindingDB Entry DOI: 10.7270/Q28W3C2N
More data for this
Ligand-Target Pair