Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | GRB2 | P62993 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28956928 | 1.00 | ALDH1A1 (0.47) | ALDH1A1PTPN1GRB2SLC7A5KDM4E | |
| SCHEMBL23574382 | 0.89 | ALDH1A1 (0.63) | ALDH1A1MEN1KMT2A | |
| SCHEMBL23574383 | 0.89 | ALDH1A1 (0.63) | ALDH1A1MEN1KMT2A | |
| SCHEMBL1983960 | 0.79 | PTPN1 (0.44) | PTPN1GRB2SLC7A5KDM4EUSP2 | |
| SCHEMBL3383262 | 0.78 | PTPN1 (0.41) | PTPN1GRB2SLC7A5KDM4EUSP2 | |
| SCHEMBL22121087 | 0.76 | SLC7A5 (0.51) | ALDH1A1PTPN1GRB2SLC7A5KDM4E | |
| SCHEMBL2977657 | 0.76 | ALDH1A1 (0.38) | ALDH1A1PTPN1TDP1MEN1KMT2A | |
| SCHEMBL5074956 | 0.76 | MAPT (0.40) | ALDH1A1PTPN1 | |
| SCHEMBL13592939 | 0.76 | ALDH3A1 (0.36) | ALDH1A1PTPN1KDM4ETDP1MEN1 | |
| SCHEMBL3385152 | 0.76 | PTPN1 (0.65) | ALDH1A1PTPN1GRB2SLC7A5KDM4E |
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-110520413-B | Macrocyclic broad spectrum antibiotics | 阿奇克斯制药公司 | 2023-02-17 | — | — | CN | disclosed |