Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28699696 | 0.83 | PDK1 (0.42) | CA12CA1CA7CA14AKT1 | |
| SCHEMBL28699685 | 0.80 | AKT1 (0.38) | KCNN4KMT2ARAB9AMEN1NPC1 | |
| SCHEMBL28715025 | 0.79 | MAPT (0.38) | KCNN4KMT2ARAB9AMEN1NPC1 | |
| SCHEMBL28708777 | 0.79 | AKT1 (0.40) | KCNN4KMT2ARAB9AMEN1NPC1 | |
| SCHEMBL4367466 | 0.74 | GPR119 (0.40) | KMT2AMEN1L3MBTL1ATM | |
| SCHEMBL23929822 | 0.73 | GAA (0.44) | KCNN4KMT2ARAB9AMEN1NPC1 | |
| SCHEMBL25866708 | 0.71 | MEN1 (0.40) | KMT2ARAB9AMEN1AKT1L3MBTL1 | |
| SCHEMBL14697845 | 0.71 | NFKB1 (0.40) | KMT2ARAB9AMEN1NPC1AKT1 | |
| SCHEMBL7659114 | 0.71 | MTOR (0.50) | KMT2AMEN1MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL775002 | 0.68 | NAMPT (0.56) | KMT2ARAB9AMEN1NPC1GAA |
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 |