Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.45 |
| ▸ | CTSK | P43235 | 3/20 | 0.45 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL266706 | 0.88 | CTSS (0.51) | CTSSCTSKS1PR3TSHRCYP3A4 | |
| SCHEMBL1162807 | 0.88 | CTSS (0.51) | CTSSCTSKS1PR3TSHRCYP3A4 | |
| SCHEMBL4815779 | 0.88 | CTSS (0.51) | CTSSCTSKS1PR3TSHRCYP3A4 | |
| SCHEMBL13059067 | 0.86 | CTSS (0.48) | CTSSCTSKRIPK1SCN9ATSHR | |
| SCHEMBL1463347 | 0.86 | CTSS (0.48) | CTSSCTSKRIPK1SCN9ATSHR | |
| SCHEMBL13306623 | 0.86 | CTSS (0.48) | CTSSCTSKRIPK1SCN9ATSHR | |
| SCHEMBL20021416 | 0.81 | CTSS (0.48) | CTSSCTSKS1PR3SCN9ATSHR | |
| SCHEMBL4070072 | 0.79 | CNR2 (0.45) | RIPK1MEN1KMT2APHGDH | |
| SCHEMBL27813795 | 0.79 | CNR2 (0.45) | RIPK1MEN1KMT2APHGDH | |
| SCHEMBL4076705 | 0.79 | CNR2 (0.45) | RIPK1MEN1KMT2APHGDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-1686999-B1 | PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES | ASTRAZENECA AB (SE) | 2009-07-01 | — | — | EP | disclosed |