Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | PKLR | P30613 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7789865 | 1.00 | MEN1 (0.52) | MEN1KMT2AALDH1A1PKMAKR1C3 | |
| SCHEMBL7787036 | 0.89 | PKM (0.54) | MEN1KMT2AALDH1A1PKMAKR1C3 | |
| SCHEMBL7787038 | 0.89 | PKM (0.54) | MEN1KMT2AALDH1A1PKMAKR1C3 | |
| SCHEMBL7790018 | 0.86 | CAPN1 (0.53) | MEN1KMT2AALDH1A1PKMAKR1C3 | |
| SCHEMBL7790014 | 0.86 | CAPN1 (0.53) | MEN1KMT2AALDH1A1PKMAKR1C3 | |
| SCHEMBL7789327 | 0.85 | ALDH1A1 (0.57) | MEN1KMT2AALDH1A1AKR1C3LMNA | |
| SCHEMBL7789330 | 0.85 | ALDH1A1 (0.57) | MEN1KMT2AALDH1A1AKR1C3LMNA | |
| SCHEMBL7791333 | 0.83 | AKR1C3 (0.54) | MEN1KMT2AALDH1A1AKR1C3LMNA | |
| SCHEMBL7791335 | 0.83 | AKR1C3 (0.54) | MEN1KMT2AALDH1A1AKR1C3LMNA | |
| SCHEMBL7786988 | 0.83 | BCL2 (0.51) | MEN1KMT2AF2PIN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6251917-B1 | Benzamidoaldehydes and their use as cysteine protease inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-26 | — | — | US | disclosed |