Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | DHODH | Q02127 | 4/20 | 0.52 |
| ▸ | CDC7 | O00311 | 3/20 | 0.52 |
| ▸ | DBF4 | Q9UBU7 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.51 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11556554 | 0.84 | ALDH1A1 (0.58) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL11000332 | 0.83 | ALDH1A1 (0.76) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL14788530 | 0.81 | ADORA3 (0.56) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL1919084 | 0.79 | ALDH1A1 (0.74) | ALDH1A1HPGDHSD17B10KDM4ENPSR1 | |
| SCHEMBL11007795 | 0.79 | CDC7 (0.43) | ALDH1A1HPGDMAPTKDM4ENPC1 | |
| SCHEMBL6816550 | 0.77 | ALDH1A1 (0.59) | ALDH1A1HPGDHSD17B10MAPTKDM4E | |
| SCHEMBL3404515 | 0.77 | ADORA3 (0.58) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL16986060 | 0.77 | HPGD (0.47) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL30852499 | 0.76 | CDC7 (0.44) | ALDH1A1HPGDHSD17B10MAPTMAPK1 | |
| SCHEMBL17870976 | 0.76 | KMT2A (0.49) | ALDH1A1HPGDHSD17B10MAPTMAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4544752-A | TREATMENT OF GOUT; ANTIARTHRITIC AGENTS | ELI LILLY AND COMPANY (US) | 1985-10-01 | — | — | US | disclosed |
| EP-0048615-B1 | IMPROVEMENTS IN OR RELATING TO 3-ARYL-5-ISOTHIAZOLE DERIVATIVES | ELI LILLY AND COMPANY (US) | 1984-05-30 | — | — | EP | disclosed |
| US-4346094-A | ENZYME INHIBITORS | ELI LILLY AND COMPANY (US) | 1982-08-24 | — | — | US | disclosed |
| EP-0048615-A1 | Improvements in or relating to 3-aryl-5-isothiazole derivatives | ELI LILLY AND COMPANY (US) | 1982-03-31 | — | — | EP | disclosed |