Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | ACHE | P22303 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | MGAM | O43451 | 1/20 | 0.58 |
| ▸ | SI | P14410 | 1/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.58 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 9/20 | 0.57 |
| ▸ | CA12 | O43570 | 8/20 | 0.57 |
| ▸ | CA1 | P00915 | 6/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.57 |
| ▸ | CA7 | P43166 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | CA4 | P22748 | 3/20 | 0.57 |
| ▸ | CA6 | P23280 | 3/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Scoparone SCHEMBL240777 | 0.78 | MCL1 (1.00) | MCL1GAAACHECA9CA12 | |
| Scoparone SCHEMBL29714063 | 0.78 | MCL1 (1.00) | MCL1GAAACHECA9CA12 | |
| SCHEMBL11194490 | 0.77 | GAA (0.64) | MCL1GAAACHENPC1RAB9A | |
| Psoralen SCHEMBL28497870 | 0.76 | KDM4E (0.86) | MCL1GAAACHENPC1RAB9A | |
| SCHEMBL12278442 | 0.75 | PIM1 (0.39) | MCL1GAAACHENPC1RAB9A | |
| Scoparone SCHEMBL27678756 | 0.75 | MCL1 (0.93) | MCL1GAAACHECA9CA12 | |
| SCHEMBL16772357 | 0.74 | GAA (1.00) | MCL1GAAACHENPC1RAB9A | |
| Herniarin SCHEMBL61221 | 0.73 | CA12 (1.00) | MCL1GAANPC1RAB9ACA9 | |
| SCHEMBL16403660 | 0.73 | MCL1 (0.42) | MCL1GAACA9CA12CA1 | |
| Herniarin SCHEMBL29437733 | 0.73 | CA12 (1.00) | MCL1GAANPC1RAB9ACA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3649183-A1 | SILICONE COMPOUNDS | The Procter and Gamble Company (US) | 2020-05-13 | — | — | EP | claimed |
| WO-2019010263-A1 | SILICONE COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 2019-01-10 | — | — | WO | claimed |