Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8799514 | 0.82 | TSHR (0.50) | ALDH1A1MAPK1HPGDMAPTLMNA | |
| SCHEMBL27621169 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MAPK1RAB9AMEN1KMT2A | |
| SCHEMBL9142431 | 0.80 | MASP2 (0.51) | ALDH1A1MAPK1MEN1KMT2AHPGD | |
| SCHEMBL4063903 | 0.80 | ALDH1A1 (0.61) | ALDH1A1MAPK1RAB9AMEN1KMT2A | |
| SCHEMBL29650091 | 0.80 | ALDH1A1 (0.61) | ALDH1A1MAPK1RAB9AMEN1KMT2A | |
| SCHEMBL8799443 | 0.79 | TBXAS1 (0.38) | ALDH1A1MEN1KMT2AHPGDNPSR1 | |
| SCHEMBL28218587 | 0.78 | ALDH1A1 (0.59) | ALDH1A1MAPK1RAB9AMEN1KMT2A | |
| SCHEMBL8800375 | 0.78 | ALDH1A1 (0.47) | ALDH1A1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL875441 | 0.77 | ALDH1A1 (0.56) | ALDH1A1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL11561330 | 0.76 | MEN1 (0.49) | ALDH1A1MAPK1RAB9AMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0365328-B1 | Pyridine derivatives | ZENECA LTD (GB) | 1996-04-03 | — | — | EP | disclosed |
| US-5053415-A | Antiischemic, antiinflammatory, antiarthritic agents, cardiovascular disorders | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-10-01 | — | — | US | disclosed |
| EP-0365328-A2 | Pyridine derivatives | ZENECA LIMITED (GB) | 1990-04-25 | — | — | EP | disclosed |