Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | CD38 | P28907 | 12/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| L-697661 SCHEMBL599639 | 0.84 | FABP4 (0.34) | NPC1 | |
| SCHEMBL9283257 | 0.83 | ADRA2A (0.32) | — | |
| SCHEMBL9456135 | 0.83 | — | — | |
| SCHEMBL9846262 | 0.82 | IDH1 (0.34) | GAAPDE3BPDE3A | |
| SCHEMBL9455992 | 0.78 | HCAR2 (0.33) | — | |
| SCHEMBL9171193 | 0.77 | FABP4 (0.34) | CD38CYP3A4 | |
| SCHEMBL9846309 | 0.76 | FABP4 (0.31) | NPC1 | |
| SCHEMBL9846072 | 0.76 | TYMS (0.32) | — | |
| SCHEMBL9680329 | 0.73 | PTGES (0.31) | — | |
| SCHEMBL9846215 | 0.73 | FABP4 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0481802-A1 | Hydroxylated inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1992-04-22 | — | — | EP | claimed |
| EP-0481802-A1 | Hydroxylated inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1992-04-22 | — | — | EP | disclosed |