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 |
---|---|
EGFR, ERBB2, ERBB3, ERBB4 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | BTK, JAK3, PTK2 |
10 (confirmed non-binding) |
Batch Information for HMSL10085-101-1:
HMS LINCS Batch ID: | 10085-101-1 |
Provider: | Nathanael Gray (DFCI) |
Provider Batch ID: | WZ4002-1 |
Salt: | 101 |
Molecular Formula: | C25H27ClN6O3 |
Molecular Weight: | 494.97 |
Purity: | |
Purification Method: | |
Chemical Synthesis Reference: | |
Comments: | |
Date Publicly Available: | 2011-07-15 |
Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10085-101-1:
Date | HMS QC Outcome | Comment | Files |
---|---|---|---|
11/24/2015 | PASS | HMSL10085-101-1_LCMS.pdf |
(Kd <100 nM)