VX-745 - Small Molecule (ID:10168-999)

HMS LINCS ID: 10168-999
Name: VX-745
Alternative Names:
LINCS ID: LSM-1169
PubChem CID: 3038525
ChEBI ID:
ChEMBL ID:
Molecular Mass: 434.98
InChi: InChI=1S/C19H9Cl2F2N3OS/c20-11-2-1-3-12(21)17(11)18-14-5-7-16(25-26(14)9-24-19(18)27)28-15-6-4-10(22)8-13(15)23/h1-9H
InChi Key: VEPKQEUBKLEPRA-UHFFFAOYSA-N
SMILES: C1=CC(=C(C(=C1)Cl)C2=C3C=CC(=NN3C=NC2=O)SC4=C(C=C(C=C4)F)F)Cl
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update: 2016-07-12

Target Affinity:

(see Study 20000)
Target Affinity Spectrum Value HUGO Gene Name
1
(Kd <100 nM)
MAPK11, Mapk14, MAPK14
3
(equivalent to 1µM ≤ Kd < 10 µM)
ABL2, BLK, CDK2, CHUK, CSF1R, CSNK1A1, DDR1, DYRK1A, EPHA1, EPHA2, EPHB1, ERBB4, FGR, FYN, GRK5, IGF1R, IKBKB, KDR, LCK, LYN, MAP4K2, MAPK1, MAPK10, MAPK12, MAPK13, MAPKAPK2, MST1R, PDGFRA, PDGFRB, PIM1, PRKCG, PRKCZ, ROCK1, ROCK2, RPS6KB1, SGK2, SRC, TAOK1, TBK1, YES1
10
(confirmed non-binding)
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Batch Information for HMSL10168-999-2:

HMS LINCS Batch ID: 10168-999-2
Provider:
Provider Batch ID:
Salt: 999
Molecular Formula:
Molecular Weight:
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2016-05-27
Most Recent Update: 2016-12-02