Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.44 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7693196 | 1.00 | NPC1 (0.53) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL7161060 | 0.94 | MAPT (0.59) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL7161066 | 0.94 | MAPT (0.59) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL30802494 | 0.84 | MAPT (0.63) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL27963761 | 0.81 | MAPT (0.60) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL7691144 | 0.79 | NPC1 (0.49) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL7158528 | 0.77 | MAPT (0.64) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL20603943 | 0.76 | MAPT (0.65) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL30826715 | 0.76 | MAPT (0.64) | NPC1RAB9AMAPTNFKB1MAPK1 | |
| SCHEMBL12970394 | 0.76 | MAPT (0.64) | NPC1RAB9AMAPTNFKB1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002006235-A1 | HETEROCYCLIC BETA-3 ADRENERGIC RECEPTOR AGONISTS | WYETH (US) | 2002-01-24 | — | — | WO | disclosed |