Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1765602 | 0.90 | ALDH1A1 (0.57) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL340013 | 0.89 | ALDH1A1 (0.73) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL31411213 | 0.89 | ALDH1A1 (0.73) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL5681640 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL13454410 | 0.82 | ALDH1A1 (0.57) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL30504387 | 0.81 | KMT2A (0.52) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL28065804 | 0.81 | ALDH1A1 (0.49) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| 2-Phenylphenol SCHEMBL9174471 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL4283437 | 0.79 | NPC1 (0.58) | ALDH1A1TDP1HPGDHSD17B10ALOX15 | |
| SCHEMBL585227 | 0.79 | ESR1 (0.57) | ALDH1A1HPGDHSD17B10ALOX15NPC1 |
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-6265620-B1 | REACTING OLEFINIC COMPOUND WITH CARBON MONOXIDE AND HYDROGEN IN PRESENCE OF CATALYST CONTAINING METAL OF GROUP 8 TO 10 AND TRIVALENT ORANIC PHOSPHORUS COMPOUND TO PRODUCE ALDEHYDE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-24 | — | — | US | disclosed |