Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 2/20 | 0.43 |
| ▸ | MMP13 | P45452 | 2/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.42 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CCR6 | P51684 | 1/20 | 0.42 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7942748 | 0.91 | ALDH1A1 (0.55) | ALDH1A1RECQLMMP8KMT2AMEN1 | |
| SCHEMBL28796267 | 0.87 | ALDH1A1 (0.49) | ALDH1A1RECQLMMP8CACNA1GKMT2A | |
| SCHEMBL28796243 | 0.86 | ALDH1A1 (0.48) | ALDH1A1RECQLMMP8KMT2ASNCA | |
| SCHEMBL28796282 | 0.86 | MMP8 (0.51) | ALDH1A1RECQLMMP8KMT2AMEN1 | |
| SCHEMBL28796264 | 0.86 | ALDH1A1 (0.48) | ALDH1A1RECQLMMP8KMT2AMEN1 | |
| SCHEMBL28796335 | 0.81 | AR (0.44) | ALDH1A1RECQLMMP8KMT2ATDP1 | |
| SCHEMBL9555278 | 0.79 | PTPN1 (0.47) | ALDH1A1RECQLMMP8KMT2AMEN1 | |
| SCHEMBL28873305 | 0.79 | ALDH1A1 (0.42) | ALDH1A1RECQLMMP8CACNA1GKMT2A | |
| SCHEMBL29048912 | 0.79 | MMP8 (0.46) | ALDH1A1RECQLMMP8KMT2AMEN1 | |
| SCHEMBL6800776 | 0.77 | MMP1 (0.43) | ALDH1A1MMP8MMP1MMP13LTA4H |
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-109694334-B | Solvent-free preparation method of disubstituted cyanoacetate compound | 西华大学 | 2022-07-22 | — | — | CN | disclosed |