Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18825085 | 0.79 | HIF1A (0.41) | CHEK1ALDH1A1KMT2AMEN1 | |
| SCHEMBL5358334 | 0.77 | ALDH1A1 (0.39) | CHEK1SMN1; SMN2ALDH1A1KMT2APOLB | |
| SCHEMBL6090987 | 0.77 | CHEK1 (0.51) | CHEK1ALDH1A1KMT2APOLB | |
| SCHEMBL6088742 | 0.75 | KDM4E (0.46) | CHEK1ALDH1A1KMT2APOLB | |
| SCHEMBL6088559 | 0.75 | KDR (0.46) | CHEK1ALDH1A1KMT2APOLB | |
| SCHEMBL6090420 | 0.74 | CHEK1 (0.43) | CHEK1MAPK1ALDH1A1KMT2APOLB | |
| SCHEMBL6744702 | 0.74 | HTR6 (0.42) | CHEK1 | |
| SCHEMBL6091127 | 0.73 | KDR (0.40) | CHEK1ALDH1A1 | |
| SCHEMBL1981272 | 0.72 | KDR (0.51) | CHEK1 | |
| SCHEMBL4405794 | 0.72 | SRC (0.35) | CHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |
| CN-1193026-C | Z-pyrazoline-5-ones | BASF AG (DE) | 2005-03-16 | — | — | CN | disclosed |
| CN-1377346-A | Z-pyrazoline-5-ones | BASF AG (DE) | 2002-10-30 | — | — | CN | 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 |