Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14930222 | 0.90 | TSHR (0.52) | ALDH1A1HPGDNPC1GAARAB9A | |
| SCHEMBL22077658 | 0.89 | MAPT (0.52) | ALDH1A1HPGDNPC1RAB9AMAPT | |
| SCHEMBL24332395 | 0.85 | RXRA (0.54) | NPC1RAB9AMAPTKDM4ETP53 | |
| SCHEMBL16197930 | 0.84 | MEN1 (0.47) | ALDH1A1NPC1RAB9ATSHRMAPT | |
| SCHEMBL22077663 | 0.79 | PDE3B (0.51) | ALDH1A1HPGDNPC1RAB9ATSHR | |
| SCHEMBL14925499 | 0.79 | MAPT (0.49) | ALDH1A1HPGDNPC1GAARAB9A | |
| SCHEMBL14925500 | 0.78 | GAA (0.51) | ALDH1A1HPGDNPC1GAARAB9A | |
| SCHEMBL10033451 | 0.77 | MAPT (0.66) | ALDH1A1HPGDNPC1RAB9AMAPT | |
| SCHEMBL17088069 | 0.77 | APP (0.51) | ALDH1A1HPGDNPC1RAB9AMAPT | |
| SCHEMBL24244072 | 0.77 | RAB9A (0.44) | ALDH1A1HPGDNPC1GAARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3892616-A1 | AROMATIC RING DERIVATIVE AS IMMUNOREGULATION AND PREPARATION METHOD AND APPLICATION OF AROMATIC RING DERIVATIVE | Shanghai Jemincare Pharmaceuticals Co., Ltd. (CN) | 2021-10-13 | — | — | EP | disclosed |