Ruxolitinib - Small Molecule (ID:10138-101)

HMS LINCS ID: 10138-101
Name: Ruxolitinib
Alternative Names:
LINCS ID: LSM-1139
PubChem CID: 25126798
ChEBI ID:
ChEMBL ID:
Molecular Mass: 306.16
InChi: InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1
InChi Key: HFNKQEVNSGCOJV-OAHLLOKOSA-N
SMILES: C1CCC(C1)[C@@H](CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3
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)
CAMK2A, CAMK2D, DAPK1, DAPK2, DAPK3, DCLK1, GAK, JAK1, JAK2, JAK3, LRRK2, MAP3K2, ROCK1, ROCK2, TYK2
2
(equivalent to 100 nM ≤ Kd < 1µM)
AAK1, ANKK1, BMP2K, BMPR2, CAMK1, CAMK1D, CAMK2B, CAMK2G, CLK2, CLK4, DCLK2, DCLK3, DYRK1A, GRK1, GRK5, GRK7, IRAK1, LTK, MAP2K3, MAP3K19, MAP3K3, MAP3K7, MARK2, MAST1, MKNK2, MYLK, NTRK2, NTRK3, NUAK2, PLK1, PLK3, PLK4, PRKACA, PRKCE, PRKG2, RET, RPS6KA1, RPS6KA2, RPS6KA4, RPS6KA5, RPS6KA6, STK16, TAOK2, TAOK3, TNK2, TTK, ULK1, ULK2
3
(equivalent to 1µM ≤ Kd < 10 µM)
ABL1, ACVR1, AIM1, ALK, AURKA, AURKB, AURKC, BMPR1B, BRAF, BTK, BUB1B-PAK6, CAMK1G, CASK, CDK5, CDK7, CDK8, CDK9, CSF1R, CSNK1A1, CSNK2A1, CSNK2A2, DMPK, DYRK1B, DYRK2, EPHA3, EPHB6, ERN1, FGFR1, FLG, FLT1, FYN, GRK4, GSK3A, GSK3B, HIPK1, HIPK2, HIPK3, IGF1R, IKBKB, IKBKE, KDR, KIT, LCK, MAP2K1, MAP2K2, MAP2K4, MAP3K1, MAP3K15, MAP4K2, MAP4K4, MAPK14, MAPK8, MAPK9, MELK, MST1R, NEK3, NEK7, NTRK1, OSR1, OXSR1, PAK4, PAK5, PAK6, PDGFRA, PDGFRB, PHKG1, PHKG2, PI4KB, PIM1, pknB, PLK2, PRKAA1, PRKCQ, PRKD3, PRKX, PTK2, RIOK1, RIOK2, RIOK3, RIPK4, RPS6KA3, SBK1, SBK3, SIK3, SRPK1, SRPK3, STK17A, STK17B, STK25, STK26, STK39, TAOK1, TBK1, TYRO3, ULK3, VRK2
10
(confirmed non-binding)
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Batch Information for HMSL10138-101-5:

HMS LINCS Batch ID: 10138-101-5
Provider: Selleck Chemicals
Provider Batch ID:
Salt: 101
Molecular Formula: C17H18N6
Molecular Weight: 306.37
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2015-06-26
Most Recent Update: 2016-12-02