Lapatinib - Small Molecule (ID:10051-104)

HMS LINCS ID: 10051-104
Name: Lapatinib
Alternative Names: GW-572016; Tykerb
LINCS ID: LSM-1051
PubChem CID: 208908
ChEBI ID:
ChEMBL ID: 554
Molecular Mass: 580.13
InChi: InChI=1S/C29H26ClFN4O4S/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35)
InChi Key: BCFGMOOMADDAQU-UHFFFAOYSA-N
SMILES: CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl
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)
EGFR, ERBB2, ERBB4, Tuba1a
2
(equivalent to 100 nM ≤ Kd < 1µM)
PI4KB, PIK3C2B, RAF1
3
(equivalent to 1µM ≤ Kd < 10 µM)
CDC7, CDK1, CHEK2, CHUK, CSNK1A1, DYRK1A, DYRK3, DYRK4, EEF2K, ERBB3, GRK5, HIPK2, HIPK4, IKBKB, IRAK1, MAP2K5, MAP2K7, MAP4K2, MAPK13, MATK, MINK1, MST1R, NEK4, PASK, PIK3C2G, PRKCG, PRKCI, PRKCZ, RIPK2, ROCK1, ROCK2, RPS6KB1, SLK, STK10, TAOK1, TBK1, TSSK2
10
(confirmed non-binding)
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Batch Information for HMSL10051-104-1:

HMS LINCS Batch ID: 10051-104-1
Provider: Haoyuan chemexpress
Provider Batch ID: HY-999-20101220
Salt: 104
Molecular Formula: C43H42ClFN4O10S3
Molecular Weight: 925.46
Purity:
Purification Method:
Chemical Synthesis Reference:
Comments:
Date Publicly Available: 2011-07-15
Most Recent Update: 2016-04-04

HMS QC Testing Events for HMSL10051-104-1:

Date HMS QC Outcome Comment Files
03/13/2015 PASS HMSL10051-104-1_LCMS.pdf
02/22/2011 PASS None