Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 10/20 | 0.63 |
| ▸ | PTK2 | Q05397 | 10/20 | 0.63 |
| ▸ | AKT1 | P31749 | 2/20 | 0.63 |
| ▸ | PLK1 | P53350 | 6/20 | 0.61 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.56 |
| ▸ | METAP2 | P50579 | 1/20 | 0.55 |
| ▸ | METAP1 | P53582 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7175864 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7173200 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7178625 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7173513 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7174476 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7176548 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| Hydrochloric Acid SCHEMBL7183099 | 0.79 | MEN1 (0.60) | KDRPTK2AKT1PLK1AURKB | |
| SCHEMBL1273984 | 0.79 | METAP2 (0.61) | KDRPTK2PLK1METAP2METAP1 | |
| SCHEMBL29779792 | 0.79 | METAP2 (0.61) | KDRPTK2PLK1METAP2METAP1 | |
| SCHEMBL13239249 | 0.78 | KDR (0.58) | KDRPTK2AKT1PLK1AURKB |
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-2022063140-A1 | PYRIMIDINE AND PYRIDINE DERIVATIVES AS HPK1 MODULATOR AND METHODS USING SAME | SHENZHEN IONOVA LIFE SCIENCE CO., LTD. (CN) | 2022-03-31 | — | — | WO | disclosed |