Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TPMT | P51580 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6551314 | 0.89 | ALDH1A1 (0.55) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28463608 | 0.82 | CCR6 (0.59) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28465274 | 0.82 | ALDH1A1 (0.55) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL31195505 | 0.82 | ALDH1A1 (0.55) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28394615 | 0.82 | MEN1 (0.55) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28471234 | 0.82 | MEN1 (0.55) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL31195462 | 0.82 | NPC1 (0.56) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28471210 | 0.82 | NPC1 (0.56) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28471238 | 0.79 | S1PR4 (0.51) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28899288 | 0.79 | KCNK9 (0.56) | ALDH1A1NPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111747904-A | Polyfluoroalkenyl substituted oxazole compound and preparation method thereof | 南京工业大学 | 2020-10-09 | — | — | CN | claimed |
| CN-111747904-A | Polyfluoroalkenyl substituted oxazole compound and preparation method thereof | 南京工业大学 | 2020-10-09 | — | — | CN | disclosed |