Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL238243 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL238242 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL238244 | 0.83 | ALDH1A1 (0.53) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL4959625 | 0.80 | ALDH1A1 (0.46) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL8783520 | 0.80 | ALDH1A1 (0.46) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL4959620 | 0.80 | ALDH1A1 (0.46) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL12220353 | 0.77 | CTSK (0.33) | CTSKCTSS | |
| SCHEMBL601377 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL4525123 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E | |
| SCHEMBL601376 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHRL3MBTL1CYP2C9KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-119431324-A | 1- (4/5-Cyano-6-substituted pyrimidine-2-yl) -1H-pyrazole-4-formic acid compound, and preparation method and application thereof | 沈阳药科大学 | 2025-02-14 | — | — | CN | disclosed |