Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CTSD | P07339 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7791348 | 1.00 | AKR1C3 (0.46) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7787806 | 0.84 | AKR1C3 (0.52) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7782230 | 0.82 | AKR1C3 (0.50) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7782219 | 0.82 | AKR1C3 (0.53) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7782218 | 0.82 | AKR1C3 (0.53) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7782228 | 0.82 | AKR1C3 (0.50) | AKR1C3MEN1KMT2AALDH1A1POLB | |
| SCHEMBL7787778 | 0.80 | AKR1C3 (0.47) | AKR1C3MEN1KMT2AALDH1A1GPR27 | |
| SCHEMBL7782244 | 0.76 | HDAC8 (0.49) | AKR1C3MEN1KMT2AALDH1A1CTSL | |
| SCHEMBL7320774 | 0.74 | AKR1C3 (0.51) | AKR1C3MEN1KMT2AALDH1A1GPR27 | |
| SCHEMBL7787817 | 0.73 | AKR1C3 (0.53) | AKR1C3MEN1KMT2AALDH1A1GPR27 |
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 |