Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNT1 | O60563 | 1/20 | 0.58 |
| ▸ | CCND1 | P24385 | 1/20 | 0.58 |
| ▸ | CCNC | P24863 | 1/20 | 0.58 |
| ▸ | CDK8 | P49336 | 1/20 | 0.58 |
| ▸ | CDK7 | P50613 | 1/20 | 0.58 |
| ▸ | CDK9 | P50750 | 1/20 | 0.58 |
| ▸ | CCNH | P51946 | 1/20 | 0.58 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.58 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.58 |
| ▸ | LCK | P06239 | 1/20 | 0.52 |
| ▸ | BTK | Q06187 | 1/20 | 0.52 |
| ▸ | GHSR | Q92847 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | ERN1 | O75460 | 2/20 | 0.49 |
| ▸ | TDP2 | O95551 | 1/20 | 0.49 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL982808 | 0.88 | CCNT1 (0.62) | CCNT1CCND1CCNCCDK8CDK7 | |
| SCHEMBL2277469 | 0.86 | KDM4E (0.70) | GHSRKDM4EALDH1A1HPGDENPP2 | |
| Benzene SCHEMBL27399226 | 0.83 | ALDH1A1 (0.71) | CCNT1CCND1CCNCCDK8CDK7 | |
| SCHEMBL30201702 | 0.83 | ALDH1A1 (0.70) | LCKGHSRKDM4EALDH1A1HPGD | |
| SCHEMBL50552 | 0.83 | ALDH1A1 (0.70) | LCKGHSRKDM4EALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL8915608 | 0.82 | ALDH1A1 (0.68) | LCKGHSRKDM4EALDH1A1HPGD | |
| SCHEMBL29566955 | 0.82 | ALDH1A1 (0.68) | LCKGHSRKDM4EALDH1A1HPGD | |
| Iodide SCHEMBL8916427 | 0.82 | ALDH1A1 (0.68) | LCKGHSRKDM4EALDH1A1HPGD | |
| Bromide SCHEMBL8916350 | 0.82 | ALDH1A1 (0.68) | LCKGHSRKDM4EALDH1A1HPGD | |
| SCHEMBL1513161 | 0.81 | CDK8 (0.62) | CDK8GHSRERN1PLAUPLAT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8642788-B2 | Activators of executioner procaspases 3, 6 and 7 | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2014-02-04 | — | — | US | disclosed |
| CN-101965189-A | Activators of pro-caspase 3, 6 and 7 | UNIV CALIFORNIA | 2011-02-02 | — | — | CN | disclosed |
| EP-2237784-A1 | ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 | The Regents of the University of California (US) | 2010-10-13 | — | — | EP | disclosed |
| WO-2009089508-A1 | ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-07-16 | — | — | WO | disclosed |