TAK-715 - Small Molecule (ID:10060-101)

HMS LINCS ID: 10060-101
Name: TAK-715
Alternative Names:
LINCS ID: LSM-1060
PubChem CID: 9952773
ChEBI ID:
ChEMBL ID:
Molecular Mass: 399.14
InChi: InChI=1S/C24H21N3OS/c1-3-21-27-22(18-11-7-8-16(2)14-18)23(29-21)19-12-13-25-20(15-19)26-24(28)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,26,28)
InChi Key: HEKAIDKUDLCBRU-UHFFFAOYSA-N
SMILES: CCC1=NC(=C(S1)C2=CC(=NC=C2)NC(=O)C3=CC=CC=C3)C4=CC(=CC=C4)C
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)
CSNK1D, MAP4K4, MAPK14
2
(equivalent to 100 nM ≤ Kd < 1µM)
ABL1, CSNK1A1, CSNK1E, CSNK1G1, EGFR, ERBB4, FLT1, FLT4, FRK, FYN, KDR, MAPK10, MAPK11, MAPK9, MINK1, PRKD3, PTK6, TPTEP2-CSNK1E
3
(equivalent to 1µM ≤ Kd < 10 µM)
AIM1, AKT1, AKT2, ALK, AURKA, AURKB, AXL, BLK, BTK, CAMK1, CAMK2B, CAMK2D, CAMK2G, CDC7, CDK1, CDK2, CHEK1, CHEK2, CHUK, CLK2, CSF1R, CSNK1G2, CSNK1G3, CSNK2A1, DAPK3, DYRK1A, DYRK3, DYRK4, EEF2K, EPHA2, ERBB2, FER, FES, FGFR1, FGFR3, FLG, FLT3, GSK3A, GSK3B, HIPK2, HIPK4, IGF1R, IKBKB, INSR, IRAK1, ITK, JAK2, JAK3, KIT, LCK, LYN, MAP4K2, MAP4K5, MAPK1, MAPK12, MAPK13, MAPK8, MAPKAPK2, MAPKAPK5, MARK2, MARK3, MATK, MELK, MET, NEK4, NTRK1, NTRK2, NTRK3, PAK4, PDK1, PDPK1, PHKG2, PIM2, PIM3, PKD2, PKN2, PLK1, PLK3, PLK4, PRKAA1, PRKACA, PRKCD, PRKCG, PRKCI, PRKCZ, PRKD2, PRKG1, PRKG2, PRKX, PTK2, PTK2B, RET, ROCK2, ROS1, RPS6KA3, RPS6KA5, RPS6KB1, SLK, SRC, SRMS, SRPK1, STK17A, STK3, SYK, TSSK1B, TSSK2, TYK2, TYRO3
10
(confirmed non-binding)
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Batch Information for HMSL10060-101-1:

HMS LINCS Batch ID: 10060-101-1
Provider: Haoyuan chemexpress
Provider Batch ID: HY-999-20110107
Salt: 101
Molecular Formula: C24H21N3OS
Molecular Weight: 399.51
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10060-101-1:

Date HMS QC Outcome Comment Files
03/13/2015 PASS HMSL10060-101-1_LCMS.pdf
02/22/2011 PASS None