Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.57 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.57 |
| ▸ | SMO | Q99835 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.51 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | CTRC | Q99895 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7215456 | 1.00 | NPC1 (0.58) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL16199783 | 0.89 | HSD17B1 (0.57) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL12170957 | 0.88 | SMN1; SMN2 (0.52) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL7217120 | 0.88 | NPC1 (0.54) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL11524375 | 0.88 | SMO (0.57) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL7221671 | 0.88 | NPC1 (0.54) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL2944536 | 0.86 | ENPP3 (0.53) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL3271684 | 0.86 | ENPP3 (0.72) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL11566150 | 0.86 | ENPP3 (0.72) | NPC1RAB9AENPP3ENPP1SMO | |
| SCHEMBL12170985 | 0.85 | HSD17B1 (0.57) | NPC1RAB9AENPP3ENPP1SMO |
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 |
|---|---|---|---|---|---|---|---|
| US-6545009-B1 | Imidazole, oxazole and thiazole derivatives for regulation of peroxisome proliferator-activated receptor function; improving insulin resistance, treating impaired glucose tolerance and obesity, enhancing insulin sensitivity, etc. | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-04-08 | — | — | US | disclosed |
| EP-1092711-A1 | RETINOID-ASSOCIATED RECEPTOR REGULATORS | Takeda Chemical Industries, Ltd. (JP) | 2001-04-18 | — | — | EP | disclosed |