Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 1/20 | 0.32 |
| ▸ | FABP4 | P15090 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9455992 | 0.90 | HCAR2 (0.33) | TYMSFABP4IDH1MEN1ALDH1A1 | |
| SCHEMBL9846309 | 0.88 | FABP4 (0.31) | FABP4MEN1ALDH1A1HPGDKMT2A | |
| L-697661 SCHEMBL599639 | 0.86 | FABP4 (0.34) | TYMSFABP4IDH1MEN1ALDH1A1 | |
| L-697661 SCHEMBL29456987 | 0.86 | FABP4 (0.34) | TYMSFABP4IDH1MEN1ALDH1A1 | |
| SCHEMBL9846168 | 0.84 | KMT2A (0.33) | MEN1ALDH1A1HPGDKMT2A | |
| SCHEMBL9171193 | 0.79 | FABP4 (0.34) | TYMSFABP4IDH1 | |
| SCHEMBL9846215 | 0.77 | FABP4 (0.31) | FABP4 | |
| SCHEMBL9283257 | 0.77 | ADRA2A (0.32) | FABP4ALDH1A1 | |
| SCHEMBL9846262 | 0.76 | IDH1 (0.34) | IDH1KMT2A | |
| SCHEMBL9680865 | 0.76 | NPC1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |