Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.48 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16574228 | 1.00 | ALDH1A1 (0.69) | ALDH1A1CYP1A2CYP2A6RAB9ANPC1 | |
| SCHEMBL15003943 | 1.00 | ALDH1A1 (0.69) | ALDH1A1CYP1A2CYP2A6RAB9ANPC1 | |
| SCHEMBL23449267 | 0.85 | UGT2B7 (0.53) | ALDH1A1CYP1A2GAAUGT2B7MEN1 | |
| SCHEMBL21035922 | 0.85 | UGT2B7 (0.53) | ALDH1A1CYP1A2RAB9AGAAUGT2B7 | |
| SCHEMBL6542366 | 0.85 | UGT2B7 (0.53) | ALDH1A1CYP1A2GAAUGT2B7MEN1 | |
| SCHEMBL6687727 | 0.83 | ALDH1A1 (0.82) | ALDH1A1CYP1A2RAB9ANPC1KCNH3 | |
| SCHEMBL15003942 | 0.83 | ALDH1A1 (0.82) | ALDH1A1CYP1A2RAB9ANPC1KCNH3 | |
| SCHEMBL21035303 | 0.82 | ALDH1A1 (0.56) | ALDH1A1CYP1A2CYP2A6RAB9ANPC1 | |
| SCHEMBL11221573 | 0.82 | ALDH1A1 (0.86) | ALDH1A1CYP1A2KCNH3GAAMEN1 | |
| SCHEMBL15137443 | 0.82 | ALDH1A1 (1.00) | ALDH1A1CYP1A2KCNH3GAAMEN1 |
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-115745808-B | Method for preparing secondary amine compound by catalyzing reduction of imine compound | 延安大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-115745808-A | Method for preparing secondary amine compound by catalyzing reduction of imine compound | 延安大学 | 2023-03-07 | — | — | CN | disclosed |