Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.73 |
| ▸ | RAB9A | P51151 | 5/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28375928 | 1.00 | NPC1 (0.73) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28375934 | 0.88 | NPC1 (0.68) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL13412684 | 0.85 | NPC1 (0.77) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28376636 | 0.85 | NPC1 (0.59) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28372141 | 0.85 | RAB9A (0.59) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3297579 | 0.85 | NPC1 (0.81) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| Drometrizole SCHEMBL2548258 | 0.85 | NPC1 (1.00) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| Drometrizole SCHEMBL29350665 | 0.85 | NPC1 (1.00) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| Drometrizole SCHEMBL15616 | 0.85 | NPC1 (1.00) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 | |
| Drometrizole SCHEMBL27755727 | 0.85 | NPC1 (1.00) | NPC1RAB9ALMNAALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110981824-A | Compound containing benzotriazole structure and preparation method and application thereof | 佛山华铕光电材料股份有限公司 | 2020-04-10 | — | — | CN | disclosed |