Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 1/20 | 0.35 |
| ▸ | QPCT | Q16769 | 1/20 | 0.31 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.31 |
| ▸ | MDM2 | Q00987 | 6/20 | 0.31 |
| ▸ | TP53 | P04637 | 5/20 | 0.31 |
| ▸ | MTOR | P42345 | 2/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | HCK | P08631 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.31 |
| ▸ | PRKDC | P78527 | 1/20 | 0.31 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.31 |
| ▸ | ACP1 | P24666 | 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 | |
|---|---|---|---|---|
| SCHEMBL24418244 | 1.00 | NT5E (0.35) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL24418242 | 0.91 | NT5E (0.36) | NT5EQPCTQPCTL | |
| SCHEMBL29639798 | 0.91 | NT5E (0.36) | NT5EQPCTQPCTL | |
| SCHEMBL24418488 | 0.91 | NT5E (0.36) | NT5EQPCTQPCTL | |
| SCHEMBL29467441 | 0.90 | NT5E (0.36) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL28728598 | 0.90 | NT5E (0.36) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL24514847 | 0.86 | NT5E (0.39) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL29614342 | 0.86 | NT5E (0.39) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL22869348 | 0.84 | NT5E (0.49) | NT5EQPCTQPCTLMDM2TP53 | |
| SCHEMBL22869335 | 0.84 | NT5E (0.49) | NT5EQPCTQPCTLMDM2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022095953-A1 | PYRIDAZINE ALKYNE COMPOUNDS AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2022-05-12 | — | — | WO | disclosed |
| CN-114437038-A | Pyridazine alkyne compound and application thereof | 武汉人福创新药物研发中心有限公司 | 2022-05-06 | — | — | CN | disclosed |