Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | CDC25A | P30304 | 1/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | CDC25C | P30307 | 1/20 | 0.42 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL8271637 | 0.87 | NPC1 (0.58) | NPC1RAB9AALDH1A1MAPK1KDM4E | |
| SCHEMBL12055792 | 0.81 | BCL2 (0.50) | RAB9AALDH1A1IDO1CTSSCTSK | |
| SCHEMBL18627691 | 0.80 | IDO1 (0.55) | ALDH1A1IDO1CTSSCTSKKDM4E | |
| SCHEMBL19383729 | 0.78 | MEN1 (0.54) | ALDH1A1IDO1CTSSCTSKKDM4E | |
| SCHEMBL9617297 | 0.78 | IDO1 (0.47) | RAB9AALDH1A1IDO1CTSSCTSK | |
| SCHEMBL3623102 | 0.77 | IDO1 (0.59) | NPC1RAB9AALDH1A1IDO1CTSS | |
| SCHEMBL4264922 | 0.77 | NPC1 (0.59) | NPC1RAB9AALDH1A1MAPK1KDM4E | |
| SCHEMBL9705988 | 0.75 | PTGS2 (0.50) | RAB9AMAPK1IDO1CTSSCTSK | |
| SCHEMBL18731742 | 0.75 | CYP1A1 (0.55) | ALDH1A1MAPK1IDO1CTSSCTSK | |
| SCHEMBL11781553 | 0.75 | NPC1 (0.57) | NPC1RAB9AALDH1A1MAPK1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0463492-A1 | 2,6-Diarylpyridin derivatives | BAYER AG (DE) | 1992-01-02 | — | — | EP | disclosed |