Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 6/20 | 0.56 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | GPR183 | P32249 | 1/20 | 0.51 |
| ▸ | ITGAL | P20701 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.46 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28341795 | 1.00 | HPGD (0.59) | HPGDKDM4ERAB9ANPC1GPR183 | |
| SCHEMBL28341896 | 0.83 | RAB9A (0.56) | HPGDKDM4ERAB9ANPC1ITGAL | |
| SCHEMBL28341779 | 0.83 | RAB9A (0.56) | HPGDKDM4ERAB9ANPC1GPR183 | |
| SCHEMBL28341781 | 0.83 | RAB9A (0.56) | HPGDKDM4ERAB9ANPC1GPR183 | |
| SCHEMBL28341897 | 0.83 | RAB9A (0.56) | HPGDKDM4ERAB9ANPC1ITGAL | |
| SCHEMBL28339655 | 0.83 | KDM4E (0.85) | HPGDKDM4ERAB9ANPC1ITGAL | |
| SCHEMBL28339657 | 0.83 | KDM4E (0.85) | HPGDKDM4ERAB9ANPC1ITGAL | |
| SCHEMBL30738463 | 0.80 | KEAP1 (0.55) | HPGDKDM4ERAB9ANPC1GPR183 | |
| SCHEMBL11477381 | 0.80 | GPR183 (0.56) | HPGDKDM4ERAB9ANPC1GPR183 | |
| SCHEMBL11477379 | 0.80 | GPR183 (0.56) | HPGDKDM4ERAB9ANPC1GPR183 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110483432-A | A kind of acrylic compounds and preparation method thereof, pharmaceutical composition and purposes | UNIV FUDAN | 2019-11-22 | — | — | CN | disclosed |