Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 5/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | ATP6V1B1 | P15313 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | HAT1 | O14929 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PRF1 | P14222 | 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 | |
|---|---|---|---|---|
| SCHEMBL6091147 | 0.91 | SIRT1 (0.40) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E | |
| SCHEMBL6091175 | 0.89 | PDE2A (0.38) | SIRT1ATP6V1B1MAOBKDM4EEGFR | |
| SCHEMBL6091569 | 0.88 | SIRT1 (0.42) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E | |
| SCHEMBL6090352 | 0.88 | SIRT1 (0.42) | SIRT1CYP2A6GRIN2DGRIN3BGRIN1 | |
| SCHEMBL6089019 | 0.77 | SIRT1 (0.40) | SIRT1CHEK2ATP6V1B1CYP2A6GRIN2D | |
| SCHEMBL6089509 | 0.72 | CHEK1 (0.44) | CHEK2EGFR | |
| SCHEMBL6088344 | 0.71 | SIRT1 (0.46) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E | |
| SCHEMBL6089676 | 0.71 | SIRT1 (0.46) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E | |
| SCHEMBL6088341 | 0.71 | SIRT1 (0.46) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E | |
| SCHEMBL6089672 | 0.71 | SIRT1 (0.46) | SIRT1ATP6V1B1CYP2A6MAOBKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1218373-A2 | 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-03 | — | — | EP | claimed |
| WO-2001009121-A2 | 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-08 | — | — | WO | claimed |
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |
| EP-1218373-A2 | 2-PYRAZOLIN-5-ONES AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2002-07-03 | — | — | EP | disclosed |
| WO-2001009121-A2 | 2-PYRAZOLIN-5-ONES_AS TYROSINE KINASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-02-08 | — | — | WO | disclosed |