Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.56 |
| ▸ | CTSD | P07339 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.50 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28350693 | 0.87 | USP2 (0.50) | HTTALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL28355092 | 0.81 | HPGD (0.61) | ALDH1A1HPGDLMNANPC1RAB9A | |
| SCHEMBL28354844 | 0.81 | KMT2A (0.66) | HTTALDH1A1HPGDLMNAMEN1 | |
| SCHEMBL986256 | 0.81 | HTT (0.65) | HTTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL7968179 | 0.80 | CTSD (0.60) | HTTCTSDALDH1A1HPGDLMNA | |
| SCHEMBL7425750 | 0.79 | CTSD (0.64) | HTTCTSDALDH1A1HPGDLMNA | |
| SCHEMBL28355041 | 0.79 | SMN1; SMN2 (0.57) | ALDH1A1HPGDLMNAKMT2ANPC1 | |
| SCHEMBL28354774 | 0.79 | NPC1 (0.56) | ALDH1A1HPGDLMNAMEN1KMT2A | |
| SCHEMBL9492867 | 0.78 | CTSD (0.66) | HTTCTSDALDH1A1HPGDLMNA | |
| SCHEMBL28738502 | 0.78 | CTSD (0.66) | HTTCTSDALDH1A1HPGDLMNA |
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-110713458-B | N- (2-benzoylaminoethyl) -2-chloronicotinamide compound and preparation method and application thereof | 浙江工业大学 | 2021-06-29 | — | — | CN | disclosed |
| CN-110713458-A | N- (2-benzoylaminoethyl) -2-chloronicotinamide compound and preparation method and application thereof | 浙江工业大学 | 2020-01-21 | — | — | CN | disclosed |