Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.36 |
| ▸ | ITGAV | P06756 | 2/20 | 0.36 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.36 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PPIA | P62937 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ITGA5 | P08648 | 2/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8683591 | 0.84 | NPC1 (0.43) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL11562843 | 0.72 | HCAR3 (0.54) | NPC1RAB9AMAPTGAAKMT2A | |
| SCHEMBL8683588 | 0.71 | NPC1 (0.44) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL8682252 | 0.70 | KDM4E (0.42) | NPC1RAB9AHTTMAPTKMT2A | |
| SCHEMBL8684069 | 0.67 | RAB9A (0.46) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL7377874 | 0.66 | TOP2A (0.53) | NPC1RAB9AHTTALDH1A1ALOX12 | |
| SCHEMBL14289015 | 0.66 | ITGB3 (0.60) | NPC1RAB9AHTTKMT2AMEN1 | |
| SCHEMBL15714331 | 0.65 | TOP2A (0.52) | NPC1RAB9AALDH1A1ALOX12ITGB3 | |
| SCHEMBL11954569 | 0.65 | TOP2A (0.57) | NPC1RAB9AHTTALDH1A1ITGB1 | |
| SCHEMBL16607505 | 0.65 | ALDH1A1 (0.53) | NPC1RAB9AGAAALDH1A1ITGB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5760028-A | TREATING CANCER METASTASIS, DIABETIC RETINOPATHY, NEOVASCULAR GLAUCOMA, THROMBOSIS, RESTENOSIS, OSTEOPOROSIS, MACULAR DEGENERATION | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-06-02 | — | — | US | disclosed |