Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 4/20 | 0.46 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TOP1 | P11387 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TOP2A | P11388 | 1/20 | 0.44 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.44 |
| ▸ | WDR5 | P61964 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 2/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MASP2 | O00187 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3240849 | 0.83 | MKNK1 (0.41) | ALDH1A1HPGDHSD17B10LMNA | |
| SCHEMBL1499925 | 0.77 | CRBN (0.45) | ALDH1A1TOP1HPGD | |
| SCHEMBL667853 | 0.76 | ESR1 (0.42) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL209238 | 0.72 | NQO2 (0.46) | NQO2PRMT1ALDH1A1TOP1HPGD | |
| SCHEMBL27490806 | 0.72 | CHRNB4 (0.39) | ALDH1A1HSD17B10TDP1LMNA | |
| SCHEMBL27411282 | 0.72 | POLB (0.41) | HPGDCASP1HSD17B10 | |
| SCHEMBL30594257 | 0.72 | MAOB (0.39) | ALDH1A1HPGDTDP1LMNA | |
| SCHEMBL24035501 | 0.71 | MKNK1 (0.37) | — | |
| SCHEMBL570014 | 0.71 | CHRNB4 (0.42) | ALDH1A1TDP1LMNA | |
| SCHEMBL27663507 | 0.70 | PHGDH (0.39) | ALDH1A1HPGD |
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-1202893-A | Novel isoxazoline and isoxazole fibrinogen receptor antagonists | DU PONT MERCK PHARMA (US) | 1998-12-23 | — | — | CN | disclosed |