Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | CATSPER1 | Q8NEC5 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20028652 | 0.84 | KDM4E (0.46) | ALDH1A1SMN1; SMN2HPGDMAPTRAB9A | |
| SCHEMBL8213973 | 0.81 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2MAOAMEN1KMT2A | |
| SCHEMBL27873777 | 0.81 | IKBKB (0.46) | ALDH1A1SMN1; SMN2HPGDMAPTRAB9A | |
| SCHEMBL11400972 | 0.77 | AKT1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL28401325 | 0.75 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL703836 | 0.73 | PIN1 (0.52) | ALDH1A1SMN1; SMN2HPGDHTTRAB9A | |
| SCHEMBL704640 | 0.73 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2KMT2AHPGDMAPT | |
| SCHEMBL30647527 | 0.71 | PIN1 (0.54) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD | |
| SCHEMBL16990081 | 0.70 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2MAOAKMT2AHPGD | |
| SCHEMBL28036308 | 0.70 | KDM4E (0.54) | ALDH1A1SMN1; SMN2MEN1KMT2AHPGD |
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-107417634-A | A kind of method that two alkane of selectivity synthesis nitrogen are acylated 1,2,3 triazole compounds | 武汉工程大学 | 2017-12-01 | — | — | CN | disclosed |
| CN-107286106-A | A kind of two alkane of selectivity synthesis nitrogen are acylated the new method of 1,2,3 triazole compounds | 武汉工程大学 | 2017-10-24 | — | — | CN | disclosed |