Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 3/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
| ▸ | MELK | Q14680 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | ITGA2 | P17301 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL24671543 | 0.89 | NAMPT (0.52) | HDAC1PIK3CAMTORNAMPTMELK | |
| SCHEMBL24671531 | 0.86 | NAMPT (0.54) | PIK3CAMTORNAMPTCDK9NPC1 | |
| SCHEMBL29803468 | 0.86 | NAMPT (0.54) | PIK3CAMTORNAMPTCDK9NPC1 | |
| SCHEMBL24671017 | 0.86 | L3MBTL1 (0.42) | NAMPTCCNT1CDK9NPC1MAPK14 | |
| SCHEMBL24669379 | 0.83 | NR1H2 (0.49) | PIK3CAMTORNAMPTMELKNPC1 | |
| SCHEMBL29803391 | 0.82 | NAMPT (0.51) | NAMPTCDK9NPC1RAB9AMAPK14 | |
| SCHEMBL24670163 | 0.82 | NAMPT (0.51) | NAMPTCDK9NPC1RAB9AMAPK14 | |
| SCHEMBL29804024 | 0.81 | CCNT1 (0.51) | NAMPTCCNT1CDK9MELKNPC1 | |
| SCHEMBL29803392 | 0.81 | MELK (0.56) | CCNT1CDK9MELKITGB3ITGA2B | |
| SCHEMBL29803587 | 0.80 | MELK (0.64) | CCNT1CDK9MELKNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |