Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | ALPI | P09923 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | CASP6 | P55212 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14397985 | 0.88 | NPC1 (0.48) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL28448569 | 0.83 | L3MBTL1 (0.65) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL16022732 | 0.83 | GSK3B (0.61) | ALDH1A1POLBL3MBTL1RAB9ANPC1 | |
| SCHEMBL5866548 | 0.82 | ALDH1A1 (0.55) | ALDH1A1POLBL3MBTL1TDP1RAB9A | |
| SCHEMBL4819030 | 0.82 | CES2 (0.50) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL11007778 | 0.82 | IDO1 (0.41) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL11109330 | 0.81 | CYP4A11 (0.53) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL3799020 | 0.81 | NPC1 (0.53) | ALDH1A1POLBL3MBTL1KDM4EABL1 | |
| SCHEMBL7847522 | 0.80 | CA2 (0.50) | ALDH1A1L3MBTL1KDM4EGAARAB9A | |
| SCHEMBL10789245 | 0.79 | PRSS1 (0.47) | ALDH1A1POLBL3MBTL1KDM4EABL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |