Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039649 | 0.94 | NUDT1 (0.45) | NUDT1BACE1POLBMAPK1HSP90AA1 | |
| SCHEMBL8040785 | 0.93 | NUDT1 (0.39) | NUDT1BACE1TYRMAPK1HSP90AA1 | |
| Phenol SCHEMBL8777717 | 0.83 | NUDT1 (0.35) | NUDT1BACE1HSP90AA1THRBTHRA | |
| SCHEMBL27626 | 0.82 | NUDT1 (0.37) | NUDT1BACE1MAPK1HSP90AA1THRB | |
| SCHEMBL30345205 | 0.82 | NUDT1 (0.37) | NUDT1BACE1MAPK1HSP90AA1THRB | |
| SCHEMBL29381715 | 0.82 | NUDT1 (0.37) | NUDT1BACE1MAPK1HSP90AA1THRB | |
| SCHEMBL29706608 | 0.82 | NUDT1 (0.37) | NUDT1BACE1MAPK1HSP90AA1THRB | |
| SCHEMBL9816539 | 0.80 | NUDT1 (0.35) | NUDT1BACE1MAPK1HSP90AA1THRB | |
| SCHEMBL278752 | 0.79 | NUDT1 (0.37) | NUDT1BACE1HSP90AA1PTGDR2 | |
| SCHEMBL3184220 | 0.78 | NUDT1 (0.40) | NUDT1BACE1MAPK1HSP90AA1THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-5702861-A | BLEND OF ALKALI SOLUBLE RESIN, QUINONE DIAZIDE COMPOUND AND AN AROMATIC POLYHYDROXY COMPOUND | TOKYO OHKA KOGYO CO., LTD. (JP) | 1997-12-30 | — | — | US | disclosed |
| US-5702861-A | BLEND OF ALKALI SOLUBLE RESIN, QUINONE DIAZIDE COMPOUND AND AN AROMATIC POLYHYDROXY COMPOUND | TOKYO OHKA KOGYO CO., LTD. (JP) | 1997-12-30 | — | — | US | disclosed |