Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.36 |
| ▸ | ITGAV | P06756 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.35 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.35 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.35 |
| ▸ | ICMT | O60725 | 1/20 | 0.35 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8682249 | 0.84 | NPC1 (0.41) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL8683782 | 0.82 | ICMT (0.34) | NPC1RAB9AMAPTGAAMEN1 | |
| SCHEMBL8683588 | 0.76 | NPC1 (0.44) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL7377874 | 0.68 | TOP2A (0.53) | NPC1RAB9AHTTITGB3ITGAV | |
| SCHEMBL11562843 | 0.67 | HCAR3 (0.54) | NPC1RAB9AMAPTGAAHCAR3 | |
| SCHEMBL8684069 | 0.67 | RAB9A (0.46) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL14289015 | 0.67 | ITGB3 (0.60) | NPC1RAB9AHTTMEN1KMT2A | |
| SCHEMBL15714331 | 0.67 | TOP2A (0.52) | NPC1RAB9AITGB3ITGAVALDH1A1 | |
| SCHEMBL11954569 | 0.66 | TOP2A (0.57) | NPC1RAB9AHTTITGB3ITGAV | |
| SCHEMBL9592348 | 0.66 | HCAR3 (0.70) | NPC1RAB9AMAPTHCAR3MEN1 |
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 |