SB 203580 - Small Molecule (ID:10167-101)

HMS LINCS ID: 10167-101
Name: SB 203580
Alternative Names: RWJ 64809; PB 203580
LINCS ID: LSM-1168
PubChem CID: 176155
ChEBI ID:
ChEMBL ID:
Molecular Mass: 377.10
InChi: InChI=1S/C21H16FN3OS/c1-27(26)18-8-4-16(5-9-18)21-24-19(14-2-6-17(22)7-3-14)20(25-21)15-10-12-23-13-11-15/h2-13H,1H3,(H,24,25)
InChi Key: CDMGBJANTYXAIV-UHFFFAOYSA-N
SMILES: CS(=O)C1=CC=C(C=C1)C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)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
1
(Kd <100 nM)
CSNK1A1, CSNK1D, GAK, GCGR, MAPK10, MAPK11, MAPK12, MAPK13, Mapk14, MAPK14, NLK, RIPK2
2
(equivalent to 100 nM ≤ Kd < 1µM)
BRAF, CDC42BPG, CIT, CSNK1E, MAPK9, PF3D7_0217500, RAF1, RPS6KA1, RPS6KA6, TBXAS1, TNIK, TPTEP2-CSNK1E
3
(equivalent to 1µM ≤ Kd < 10 µM)
ABL1, ACVR1B, BMPR1B, CDC42BPA, CDC42BPB, CDC7, CDK1, CHEK2, CHUK, COQ8B, CSNK1A1L, DDR1, DDR2, DYRK1A, DYRK3, DYRK4, EEF2K, EGFR, EPHA6, EPHB2, EPHB6, ERBB4, FPGT-TNNI3K, FRK, GRK5, GSK3B, HIPK2, HIPK4, IKBKB, IRAK1, LCK, MAP2K2, MAP2K5, MAP3K20, MAP4K2, MAP4K4, MAPK8, MATK, MET, MINK1, MST1R, MT-CO1, NEK4, P2RX7, PIP5K1C, PTGS1, PTK6, ROCK1, ROCK2, RPS6KB1, SGK2, SIK3, SLK, SRC, STK32A, STK32B, STK36, TAOK1, TBK1, TGFBR1, TGFBR2, TKT, TNNI3K, TSSK2, TTK, TXK, TYK2
10
(confirmed non-binding)
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Batch Information for HMSL10167-101-1:

HMS LINCS Batch ID: 10167-101-1
Provider: Haoyuan chemexpress
Provider Batch ID: HY-10256_1-20100610
Salt: 101
Molecular Formula: C21H16FN3OS
Molecular Weight: 377.43
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10167-101-1:

Date HMS QC Outcome Comment Files
04/13/2015 PASS HMSL10167-101-1_LCMS.pdf
11/14/2011 PASS None