Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 9/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6089010 | 1.00 | KDR (0.41) | KDRCHRNB2CHRNA4ALKALDH1A1 | |
| SCHEMBL6090104 | 0.89 | KDR (0.42) | KDRCHRNB2CHRNA4ALKALDH1A1 | |
| SCHEMBL6090098 | 0.89 | KDR (0.42) | KDRCHRNB2CHRNA4ALKALDH1A1 | |
| SCHEMBL6091900 | 0.89 | KDR (0.43) | KDRCHRNB2CHRNA4ALDH1A1LMNA | |
| SCHEMBL6091902 | 0.89 | KDR (0.43) | KDRCHRNB2CHRNA4ALDH1A1LMNA | |
| SCHEMBL6091496 | 0.84 | KDR (0.52) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6091506 | 0.84 | KDR (0.52) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6088991 | 0.84 | KDR (0.39) | KDRCHRNB2CHRNA4ALKALDH1A1 | |
| SCHEMBL6088996 | 0.84 | KDR (0.39) | KDRCHRNB2CHRNA4ALKALDH1A1 | |
| SCHEMBL6092488 | 0.84 | KDR (0.42) | KDRCHRNB2CHRNA4ALKALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |