HMS LINCS Project

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GSK429286A - Small Molecule (ID:10012-101)

HMS LINCS ID:	10012-101
Name:	GSK429286A
Alternative Names:
LINCS ID:	LSM-1012
PubChem CID:	11373846
ChEBI ID:
ChEMBL ID:
Molecular Mass:	432.12
InChi:	InChI=1S/C21H16F4N4O2/c1-10-19(20(31)28-17-6-12-9-26-29-16(12)8-15(17)22)14(7-18(30)27-10)11-2-4-13(5-3-11)21(23,24)25/h2-6,8-9,14H,7H2,1H3,(H,26,29)(H,27,30)(H,28,31)
InChi Key:	OLIIUAHHAZEXEX-UHFFFAOYSA-N
SMILES:	CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=C(C=C4C(=C3)C=NN4)F
Relevant Citations:
Comments:
Date Publicly Available:
Most Recent Update:	2016-04-04

Target Affinity:

(see Study 20000)

Target Affinity Spectrum Value	HUGO Gene Name
2 (equivalent to 100 nM ≤ Kd < 1µM)	ROCK1, ROCK2, RPS6KA1
3 (equivalent to 1µM ≤ Kd < 10 µM)	RPS6KB1
10 (confirmed non-binding)	(Click to show)ABL1, ABL2, ACVR1, ACVR1B, ACVR2A, ACVR2B, ACVRL1, AKT1, ALK, ANKK1, AXL, BMPR1A, BMX, BRAF, BRSK1, BRSK2, BUB1B-PAK6, C8orf44-SGK3, CAMK1, CAMK1D, CAMK1G, CAMK2A, CAMK2B, CAMK2D, CAMK2G, CAMK4, CASK, CDC42BPA, CDC42BPG, CDK11A, CDK11B, CDK14, CDK15, CDK16, CDK17, CDK18, CDK19, CDK2, CDK3, CDK5, CDK8, CDK9, CDKL1, CDKL2, CDKL3, CHEK1, CHEK2, CHUK, CIT, CLK4, COQ8A, COQ8B, CSK, CSNK1A1, CSNK1A1L, CSNK1D, CSNK1E, CSNK1G1, CSNK1G2, CSNK1G3, CSNK2A1, CSNK2A2, DAPK1, DAPK2, DAPK3, DCLK2, DDR1, DDR2, DMPK, DYRK1A, DYRK1B, DYRK2, EGFR, EIF2AK1, EIF2AK2, EIF2AK4, EPHA1, EPHA2, EPHA3, EPHA4, EPHA5, EPHA6, EPHA7, EPHB1, EPHB2, EPHB3, EPHB4, ERBB3, FER, FES, FGFR2, FGFR3, FGR, FLT1, FLT3, FLT4, FPGT-TNNI3K, FYN, GAK, GRK1, GRK4, GRK7, GSK3A, GSK3B, HIPK1, HIPK2, HIPK3, HIPK4, HUNK, ICK, IGF1R, IKBKB, IKBKE, INSR, INSRR, IRAK1, IRAK3, IRAK4, KDR, KIT, LIMK1, LIMK2, LRRK2, LTK, MAK, MAP2K6, MAP2K7, MAP3K1, MAP3K10, MAP3K11, MAP3K13, MAP3K15, MAP3K2, MAP3K20, MAP3K3, MAP3K4, MAP3K5, MAP3K6, MAP3K7, MAP3K9, MAP4K1, MAP4K2, MAP4K3, MAP4K4, MAP4K5, MAPK10, MAPK11, MAPK12, MAPK13, MAPK14, MAPK15, MAPK4, MAPK6, MAPK7, MAPK8, MAPK9, MAPKAPK2, MAPKAPK5, MARK1, MARK2, MARK3, MARK4, MAST1, MELK, MERTK, MKNK1, MTOR, MUSK, MYLK, MYLK2, MYLK3, MYLK4, MYO3A, MYO3B, NEK1, NEK11, NEK2, NEK3, NEK4, NEK5, NEK7, NEK9, NIM1K, NLK, NTRK1, NTRK2, NTRK3, OXSR1, PAK1, PAK2, PAK4, PAK5, PAK6, PDGFRA, PDPK1, PF3D7_0217500, PF3D7_1356900, PHKG1, PHKG2, PI4KB, PIK3C2B, PIK3CA, PIK3CB, PIK3CD, PIK3CG, PIM1, PIM2, PIM3, PIP4K2B, PIP4K2C, PIP5K1A, PIP5K1C, PKMYT1, pknB, PLK1, PLK2, PLK3, PLK4, PRKCE, PRKD1, PRKD2, PRKD3, PRPF4B, PTK2, PTK2B, RAF1, RIOK1, RIOK2, RIOK3, RIPK1, RIPK2, ROS1, RPS6KA2, RPS6KA4, RPS6KA5, SBK1, SGK3, SIK1, SIK1B, SIK2, SIK3, SLK, SNRK, SRC, SRPK1, SRPK2, SRPK3, STK10, STK11, STK16, STK17A, STK17B, STK35, STK36, STK39, STK4, SYK, TAOK2, TAOK3, TBK1, TEK, TESK1, TGFBR1, TGFBR2, TIE1, TLK1, TLK2, TNIK, TNK2, TNNI3K, TPTEP2-CSNK1E, TSSK1B, TTK, TXK, TYRO3, ULK2, ULK3, VRK2, WEE1, ZAP70

Batch Information for HMSL10012-101-1:

HMS LINCS Batch ID:	10012-101-1
Provider:	Haoyuan chemexpress
Provider Batch ID:	HY-999-20100817
Salt:	101
Molecular Formula:	C21H16F4N4O2
Molecular Weight:	432.37
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available:	2011-07-15
Most Recent Update:	2016-04-04

HMS QC Testing Events for HMSL10012-101-1:

Date	HMS QC Outcome	Comment	Files
02/22/2011	PASS		None

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