Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29420512 | 0.89 | KDM4E (0.41) | CES2CES1MAPTKMT2AALDH1A1 | |
| SCHEMBL29420508 | 0.89 | AAK1 (0.42) | KMT2AALDH1A1MEN1SMN1; SMN2HPGD | |
| SCHEMBL29420507 | 0.87 | CES2 (0.39) | CES2CES1MAPTKMT2AALDH1A1 | |
| SCHEMBL29420485 | 0.86 | AAK1 (0.40) | MAPTKMT2AALDH1A1MEN1GAA | |
| SCHEMBL29420493 | 0.86 | MEN1 (0.45) | CES2CES1MAPTKMT2AALDH1A1 | |
| SCHEMBL29420487 | 0.86 | AAK1 (0.38) | MAPTKMT2AALDH1A1MEN1SMN1; SMN2 | |
| SCHEMBL29420489 | 0.86 | MEN1 (0.45) | CES2CES1MAPTKMT2AALDH1A1 | |
| SCHEMBL29420499 | 0.80 | CYP3A4 (0.45) | MAPTKMT2AALDH1A1MEN1SMN1; SMN2 | |
| SCHEMBL7927967 | 0.79 | CES2 (0.41) | CES2CES1MAPTKMT2AALDH1A1 | |
| SCHEMBL29420506 | 0.79 | L3MBTL1 (0.47) | CES2CES1MAPTKMT2AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114195676-B | Biarylhydrazine compound and adduct thereof and application of compound in preparation of antitumor drugs | 广州药本君安医药科技股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-114195676-A | Biarylhydrazine compound and adduct thereof and application of compound in preparation of antitumor drugs | 广州药本君安医药科技股份有限公司 | 2022-03-18 | — | — | CN | disclosed |