Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.59 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.51 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8697972 | 0.94 | GAA (0.62) | NPC1RAB9AGAAFFAR1ABCB1 | |
| SCHEMBL1557011 | 0.84 | FFAR1 (0.71) | NPC1RAB9AGAAFFAR1MAPT | |
| SCHEMBL23877665 | 0.82 | MAPT (0.61) | NPC1GAAMAPTHRH3ALDH1A1 | |
| Dietifen SCHEMBL2109562 | 0.81 | NPC1 (0.62) | NPC1RAB9AFFAR1ABCB1MAPT | |
| SCHEMBL8008112 | 0.81 | NPC1 (0.62) | NPC1RAB9AFFAR1ABCB1MAPT | |
| SCHEMBL1304210 | 0.81 | NPC1 (1.00) | NPC1RAB9AABCB1MAPTALDH1A1 | |
| SCHEMBL9081465 | 0.81 | NPC1 (0.76) | NPC1RAB9AFFAR1ABCB1MAPT | |
| SCHEMBL19160273 | 0.81 | GAA (0.60) | NPC1RAB9AGAAFFAR1MAPT | |
| SCHEMBL128056 | 0.81 | GAA (0.75) | NPC1RAB9AGAAMAPTALDH1A1 | |
| SCHEMBL11403932 | 0.81 | FFAR1 (0.57) | NPC1RAB9AFFAR1MAPTHRH3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0935597-A2 | DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY | WARNER-LAMBERT COMPANY (US) | 1999-08-18 | — | — | EP | claimed |
| WO-1998019997-A2 | DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY | WARNER-LAMBERT COMPANY (US) | 1998-05-14 | — | — | WO | claimed |
| US-6046355-A | TOLUENE-4-THIOSULFONIC ACID S-ESTERS AS CHEMICAL INTERMEDIATES FOR VIRICIDES AND ASPARTYL PROTEASE INHIBITORS; AIDS | WARNER-LAMBERT COMPANY (US) | 2000-04-04 | — | — | US | disclosed |
| US-5834506-A | TREATMENT OF HIV, AIDS; ANTIVIRAL ACTIVITY IMPROVED BY JUDICIOUS PLACEMENT OF POLAR SUBSTITUENTS | WARNER-LAMBERT COMPANY (US) | 1998-11-10 | — | — | US | disclosed |