WZ4002 - Small Molecule (ID:10085-101)

HMS LINCS ID: 10085-101
Name: WZ4002
Alternative Names:
LINCS ID: LSM-1085
PubChem CID: 44607530
ChEBI ID:
ChEMBL ID:
Molecular Mass: 494.18
InChi: InChI=1S/C25H27ClN6O3/c1-4-23(33)28-17-6-5-7-19(14-17)35-24-20(26)16-27-25(30-24)29-21-9-8-18(15-22(21)34-3)32-12-10-31(2)11-13-32/h4-9,14-16H,1,10-13H2,2-3H3,(H,28,33)(H,27,29,30)
InChi Key: ITTRLTNMFYIYPA-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)OC4=CC=CC(=C4)NC(=O)C=C)Cl)OC
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, ERBB3, ERBB4
2
(equivalent to 100 nM ≤ Kd < 1µM)
BTK, JAK3, PTK2
10
(confirmed non-binding)
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Datasets:

HMS Dataset ID Dataset Title HMS Dataset Type
20000
Target Affinity Spectrum (TAS) vectors for compounds in the HMS LINCS small molecule library.
Analysis
20069
WZ4002 KINOMEscan
KINOMEscan

KINOMEscan Image

Batch Information:

HMS LINCS Batch ID Provider Provider Batch ID
10085-101-1 Nathanael Gray (DFCI) WZ4002-1