Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | REN | P00797 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 3/20 | 0.36 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9588386 | 1.00 | ALDH1A1 (0.40) | ALDH1A1HPGDMAPTHSD17B10NPC1 | |
| Hydrochloric Acid SCHEMBL7302356 | 0.99 | ALDH1A1 (0.39) | ALDH1A1HPGDMAPTHSD17B10NPC1 | |
| Hydrochloric Acid SCHEMBL7302372 | 0.99 | ALDH1A1 (0.39) | ALDH1A1HPGDMAPTHSD17B10NPC1 | |
| SCHEMBL9588377 | 0.86 | ALDH1A1 (0.42) | ALDH1A1HPGDMAPTHSD17B10NPC1 | |
| Hydrochloric Acid SCHEMBL7302365 | 0.85 | ALDH1A1 (0.41) | ALDH1A1HPGDMAPTHSD17B10NPC1 | |
| SCHEMBL7303780 | 0.84 | POLB (0.48) | ALDH1A1MAPTHSD17B10USP2POLB | |
| SCHEMBL7303804 | 0.84 | POLB (0.48) | ALDH1A1MAPTHSD17B10USP2POLB | |
| Hydrochloric Acid SCHEMBL7303066 | 0.83 | PSMB1 (0.47) | ALDH1A1POLBMMP1PSMB1PSMB5 | |
| Hydrochloric Acid SCHEMBL7303062 | 0.83 | PSMB1 (0.47) | ALDH1A1POLBMMP1PSMB1PSMB5 | |
| SCHEMBL7312581 | 0.83 | ALDH1A1 (0.39) | ALDH1A1HPGDMAPTHSD17B10NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-5246968-A | — | — | None | — | — | JP | disclosed |
| JP-H05246968-A | KETONE DERIVATIVE | MITSUBISHI KASEI CORP | 1993-09-24 | — | — | JP | disclosed |