Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27325273 | 0.90 | KMT2A (0.54) | KMT2AMEN1TP53MAPTCA12 | |
| SCHEMBL27408901 | 0.90 | KMT2A (0.49) | KMT2ATDP1TP53POLBMAPT | |
| SCHEMBL27315061 | 0.88 | CYP1A2 (0.49) | KMT2AMEN1POLBCA12CA2 | |
| SCHEMBL27323098 | 0.86 | HIF1A (0.53) | KMT2AMEN1TDP1TP53POLB | |
| SCHEMBL27319189 | 0.82 | GFER (0.49) | KMT2ATP53CA12CA2CA9 | |
| SCHEMBL27322188 | 0.79 | PTGS2 (0.59) | KMT2ATP53GFERALDH1A1PTGS2 | |
| SCHEMBL27311725 | 0.78 | ALDH1A1 (0.48) | KMT2ATP53MAPTGFERKDM4E | |
| SCHEMBL28148161 | 0.78 | NPC1 (0.56) | TP53MAPTGFERHTTNPC1 | |
| SCHEMBL27315064 | 0.78 | ALDH1A1 (0.50) | KMT2ATDP1TP53POLBMAPT | |
| SCHEMBL27318291 | 0.74 | PKM (0.52) | KMT2ATDP1POLBMAPTGFER |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1051074-C | Isoxazole-4-carboxamides and hydroxyalkylidenecyanoacetamides pharmaceuticals containing these compounds and their use | HOECHST AG (DE) | 2000-04-05 | — | — | CN | disclosed |
| CN-1056684-A | Different azoles-4-carboxylic acid amides and hydroxy alkylidene Malonamide nitrile contains the medicine of these compounds and their application | HOECHST AG (DE) | 1991-12-04 | — | — | CN | disclosed |