Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL2385696 | 0.88 | NUDT1 (0.39) | NUDT1BACE1AMY1AESR1ESR2 | |
| SCHEMBL8150433 | 0.81 | OPRM1 (0.38) | NUDT1BACE1AMY1AESR1ESR2 | |
| SCHEMBL4061548 | 0.80 | NUDT1 (0.44) | NUDT1BACE1ESR1ESR2CYP2C9 | |
| SCHEMBL8141767 | 0.80 | NUDT1 (0.40) | NUDT1BACE1ESR1ESR2HSPA5 | |
| SCHEMBL2676397 | 0.80 | AMY1A (0.54) | NUDT1BACE1AMY1APTGDR2HSPA5 | |
| SCHEMBL29628813 | 0.80 | AMY1A (0.54) | NUDT1BACE1AMY1APTGDR2HSPA5 | |
| SCHEMBL29636453 | 0.80 | AMY1A (0.54) | NUDT1BACE1AMY1APTGDR2HSPA5 | |
| SCHEMBL2386130 | 0.79 | SHBG (0.43) | NUDT1BACE1ESR1ESR2CYP2C9 | |
| SCHEMBL29381510 | 0.78 | AMY1A (0.43) | NUDT1BACE1AMY1APTGDR2HSPA5 | |
| SCHEMBL34995 | 0.78 | AMY1A (0.43) | NUDT1BACE1AMY1APTGDR2HSPA5 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127087-A | COMPOSITION COMPRISING ALKALI-SOLUBLE RESIN, SPECIFIED QUINONEDIAZIDE COMPOUND | TOKYO OHKA KOGYO CO., LTD. (JP) | 2000-10-03 | — | — | US | disclosed |