Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28005109 | 0.90 | CA2 (0.42) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL28005433 | 0.85 | HTR7 (0.40) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL28005105 | 0.75 | ALDH1A1 (0.40) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL28005431 | 0.75 | HTR7 (0.40) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL10712623 | 0.73 | L3MBTL1 (0.41) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL9278761 | 0.72 | LMNA (0.48) | CA2ALDH1A1LMNATDP1SMN1; SMN2 | |
| SCHEMBL995493 | 0.72 | NPC1 (0.37) | CA2ALDH1A1LMNATDP1NPC1 | |
| SCHEMBL4468555 | 0.71 | CA2 (0.55) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL11816693 | 0.71 | CA2 (0.50) | CA2ALDH1A1LMNACES2CES1 | |
| SCHEMBL4469892 | 0.71 | CA2 (0.55) | CA2ALDH1A1LMNACES2CES1 |
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-104341449-A | Method for preparing beta-carbonyl phosphonate derivatives | UNIV SOOCHOW | 2015-02-11 | — | — | CN | disclosed |