Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | CASP1 | P29466 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31044605 | 0.76 | TAS1R3 (0.55) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL9826735 | 0.75 | TAS1R3 (0.52) | KDM4EALDH1A1HPGDCA2CA12 | |
| Hydrochloric Acid SCHEMBL10458713 | 0.74 | TAS1R3 (0.51) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL8315780 | 0.73 | TAS1R3 (0.55) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL13980462 | 0.72 | CYP2A6 (0.53) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL7922363 | 0.71 | TAS1R3 (0.52) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL11402397 | 0.71 | MAPT (0.67) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL12301434 | 0.70 | CYP2A6 (0.54) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL29527237 | 0.70 | KDM4E (0.66) | KDM4EALDH1A1HPGDCA2CA12 | |
| SCHEMBL335319 | 0.70 | KDM4E (0.66) | KDM4EALDH1A1HPGDCA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022242629-A1 | COMPOUND CONTAINING PHOSPHATE GROUP, PHARMACEUTICAL COMPOSITION CONTAINING SAME, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海日馨医药科技股份有限公司 | 2022-11-24 | — | — | WO | disclosed |