Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 4/20 | 0.35 |
| ▸ | DBF4 | Q9UBU7 | 4/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.35 |
| ▸ | CDK2 | P24941 | 3/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.33 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.33 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.33 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.33 |
| ▸ | BMPR2 | Q13873 | 1/20 | 0.33 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24576965 | 0.86 | CHEK1 (0.37) | CDC7DBF4CCNE1CDK2ROCK1 | |
| Hydrochloric Acid SCHEMBL29759885 | 0.85 | CHEK1 (0.37) | CDC7DBF4CCNE1CDK2ROCK1 | |
| SCHEMBL24576968 | 0.80 | BRD4 (0.41) | PTGS1PTGS2CHEK1MARK3 | |
| SCHEMBL24578249 | 0.77 | KDM4E (0.43) | ABL1 | |
| SCHEMBL24577782 | 0.75 | PTGS1 (0.33) | PTGS1PTGS2 | |
| SCHEMBL24577992 | 0.74 | IKBKE (0.42) | CDK2ROCK1TGFBR2ABL1 | |
| SCHEMBL17454470 | 0.74 | HAT1 (0.48) | ROCK1ROCK2BMPR1BKDRBMPR1A | |
| SCHEMBL24578329 | 0.73 | MAPT (0.30) | MAPTHPGD | |
| SCHEMBL24577563 | 0.73 | KIT (0.40) | PTGS1PTGS2KDRABL1 | |
| SCHEMBL24578161 | 0.72 | RAB9A (0.36) | MAPTHPGD |
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-2022136509-A1 | PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2022-06-30 | — | — | WO | disclosed |