Bohemine - Small Molecule (ID:10461-101)
| HMS LINCS ID: |
10461-101
|
| Name: | Bohemine |
| Alternative Names: | |
| LINCS ID: | |
| PubChem CID: | 2422 |
| ChEBI ID: | |
| ChEMBL ID: | |
| Molecular Mass: | 340.20 |
| InChi: | InChI=1S/C18H24N6O/c1-13(2)24-12-21-15-16(20-11-14-7-4-3-5-8-14)22-18(23-17(15)24)19-9-6-10-25/h3-5,7-8,12-13,25H,6,9-11H2,1-2H3,(H2,19,20,22,23) |
| InChi Key: | OPQGFIAVPSXOBO-UHFFFAOYSA-N |
| SMILES: | CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NCCCO |
| Relevant Citations: | |
| Comments: | |
| Date Publicly Available: | |
| Most Recent Update: | 2016-04-04 |
Target Affinity:
(see Study 20000)| Target Affinity Spectrum Value | HUGO Gene Name |
|---|---|
CDK2, CDK9 | |
3 (equivalent to 1µM ≤ Kd < 10 µM) | CCNB1, CCNB2, CCNB3, CDK1 |
10 (confirmed non-binding) |
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 |
Batch Information:
| HMS LINCS Batch ID | Provider | Provider Batch ID |
|---|---|---|
| 10461-101-1 | EMD Millipore | 2615618 |
(equivalent to 100 nM ≤ Kd < 1µM)