Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 3/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11138078 | 0.79 | NPC1 (0.52) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL7322868 | 0.76 | NPC1 (1.00) | NPC1RAB9AHPGDMAPTKDM4E | |
| SCHEMBL2314262 | 0.75 | HPGDS (0.56) | NPC1RAB9AHPGDHPGDSMAPT | |
| SCHEMBL7013344 | 0.74 | CYP11B2 (0.60) | HPGDSMAPTALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL2319548 | 0.74 | HPGDS (0.72) | NPC1RAB9AHPGDHPGDSMAPT | |
| Diphenylether SCHEMBL29220492 | 0.72 | CYP2A6 (0.65) | NPC1RAB9AHPGDHPGDSMAPT | |
| SCHEMBL8819870 | 0.71 | NPC1 (0.48) | NPC1RAB9AHPGDSLTA4HPOLB | |
| SCHEMBL8525305 | 0.71 | NPC1 (0.49) | NPC1RAB9AHPGDMAPTKDM4E | |
| SCHEMBL1422965 | 0.69 | NPC1 (0.71) | NPC1RAB9AHPGDMAPTKDM4E | |
| SCHEMBL8525087 | 0.68 | NPC1 (0.64) | NPC1RAB9AHPGDSMAPTKDM4E |
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-57058680-A | — | — | None | — | — | JP | disclosed |
| JP-S5758680-A | 1,2,4-TRIAZINES | SUMITOMO CHEM CO LTD | 1982-04-08 | — | — | JP | disclosed |