Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | PTPRF | P10586 | 1/20 | 0.43 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL21600877 | 1.00 | MAPT (0.48) | MAPTALDH1A1NPC1RAB9AGAA | |
| SCHEMBL30379953 | 0.81 | VCAM1 (0.47) | MAPTALDH1A1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL16982690 | 0.81 | KDM4E (0.56) | MAPTALDH1A1GAASMN1; SMN2MEN1 | |
| SCHEMBL21596393 | 0.79 | MITF (0.57) | MAPTALDH1A1NPC1RAB9AGAA | |
| SCHEMBL30379404 | 0.79 | MITF (0.57) | MAPTALDH1A1NPC1RAB9AGAA | |
| SCHEMBL21617379 | 0.78 | NPC1 (0.49) | MAPTNPC1MEN1KMT2ALMNA | |
| SCHEMBL12367217 | 0.75 | RAB9A (0.49) | MAPTALDH1A1NPC1RAB9AGAA | |
| SCHEMBL29830207 | 0.74 | MEN1 (0.61) | MAPTALDH1A1GAASMN1; SMN2MEN1 | |
| SCHEMBL21600856 | 0.71 | KDM4E (0.49) | MAPTALDH1A1GAAMEN1KMT2A | |
| SCHEMBL30380072 | 0.71 | KDM4E (0.49) | MAPTALDH1A1GAAMEN1KMT2A |
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-112313207-B | Cyano-substituted pyridine and cyano-substituted pyrimidine compounds, and preparation methods and applications thereof | 北京赛特明强医药科技有限公司 | 2023-02-14 | — | — | CN | disclosed |