I-BET151 - Small Molecule (ID:10331-101)
| HMS LINCS ID: |
10331-101
|
| Name: | I-BET151 |
| Alternative Names: | GSK1210151A |
| LINCS ID: | LSM-6335 |
| PubChem CID: | 52912189 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 415.16 |
| InChi: | InChI=1S/C23H21N5O3/c1-12-21(14(3)31-27-12)16-9-18-15(10-20(16)30-4)22-19(11-25-18)26-23(29)28(22)13(2)17-7-5-6-8-24-17/h5-11,13H,1-4H3,(H,26,29)/t13-/m1/s1 |
| InChi Key: | VUVUVNZRUGEAHB-CYBMUJFWSA-N |
| SMILES: | CC1=C(C(=NO1)C)C2=C(C=C3C(=C2)N=CC4=C3N(C(=O)N4)[C@H](C)C5=CC=CC=N5)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 |
|---|---|
BRD2, BRD3 | |
2 (equivalent to 100 nM ≤ Kd < 1µM) | BRD4 |
3 (equivalent to 1µM ≤ Kd < 10 µM) | CREBBP, PDE4B |
10 (confirmed non-binding) |
Batch Information for HMSL10331-101-1:
| HMS LINCS Batch ID: | 10331-101-1 |
| Provider: | Haoyuan chemexpress |
| Provider Batch ID: | HY-13235-20130409 |
| Salt: | 101 |
| Molecular Formula: | C23H21N5O3 |
| Molecular Weight: | 415.44 |
| Purity: | |
| Purification Method: | |
| Chemical Synthesis Reference: | |
| Comments: | |
| Date Publicly Available: | 2013-05-08 |
| Most Recent Update: | 2016-04-04 |
HMS QC Testing Events for HMSL10331-101-1:
| Date | HMS QC Outcome | Comment | Files |
|---|---|---|---|
| 04/13/2015 | PASS | HMSL10331-101-1_LCMS.pdf | |
| 05/13/2013 | PASS | None |
(Kd <100 nM)