Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 9/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11247874 | 0.92 | CACNA2D1 (0.55) | CACNA2D1MAPTTP53RAB9ASMN1; SMN2 | |
| SCHEMBL11483156 | 0.90 | PTGES (0.49) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11470726 | 0.84 | TP53 (0.50) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11469963 | 0.84 | GAA (0.48) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11467756 | 0.82 | CACNA2D1 (0.44) | CACNA2D1MAPTTP53ALDH1A1 | |
| SCHEMBL11483171 | 0.80 | RAB9A (0.49) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11865062 | 0.79 | RAB9A (0.46) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11483085 | 0.79 | ACACB (0.47) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL11475908 | 0.78 | RAB9A (0.47) | CACNA2D1MAPTTP53GAARAB9A | |
| SCHEMBL10027322 | 0.77 | NQO1 (0.64) | MAPTTP53GAARAB9ASMN1; SMN2 |
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-4318911-A | 5,6-Diaryl-1,2,4-triazines as topical antithrombotic agents | ELI LILLY AND COMPANY (US) | 1982-03-09 | — | — | US | disclosed |