Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520533 | 0.88 | NPC1 (0.41) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29037718 | 0.88 | NPC1 (0.41) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29520298 | 0.85 | NPC1 (0.39) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29037736 | 0.85 | DYRK1A (0.44) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29520550 | 0.85 | DYRK1A (0.44) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29037825 | 0.83 | MEN1 (0.42) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29520505 | 0.83 | MEN1 (0.42) | TGFBR1NPC1RAB9AGFERDYRK1A | |
| SCHEMBL29037887 | 0.77 | DYRK1A (0.52) | TGFBR1NPC1RAB9ADYRK1ATGFBR2 | |
| SCHEMBL29520156 | 0.77 | DYRK1A (0.52) | TGFBR1NPC1RAB9ADYRK1ATGFBR2 | |
| SCHEMBL29520513 | 0.75 | SYK (0.44) | TGFBR1NPC1RAB9AGFERDYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116456985-A | Pyrimidine and pyridine derivatives as HPK1 modulators and methods of use thereof | 深圳市原力生命科学有限公司 | 2023-07-18 | — | — | CN | disclosed |
| 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 |