Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL8683591 | 0.76 | NPC1 (0.43) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL8682249 | 0.71 | NPC1 (0.41) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL8684065 | 0.65 | RAB9A (0.47) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL23518343 | 0.64 | MAPT (0.65) | NPC1RAB9AHTTMAPTALDH1A1 | |
| SCHEMBL27974080 | 0.63 | KDM4E (0.52) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL8494757 | 0.63 | KDM4E (0.52) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL20027590 | 0.61 | KDM4E (0.50) | NPC1RAB9AHTTMAPTGAA | |
| SCHEMBL304684 | 0.61 | CA12 (0.49) | NPC1RAB9AMAPTALDH1A1MEN1 | |
| SCHEMBL1568064 | 0.61 | RAB9A (0.59) | NPC1RAB9AHTTMAPTGAA | |
| Hydrochloric Acid SCHEMBL27898270 | 0.61 | LMNA (0.46) | NPC1RAB9AHTTMAPTGAA |
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 |