Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CTSL | P07711 | 2/20 | 0.49 |
| ▸ | MMP9 | P14780 | 2/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | MMP7 | P09237 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 7/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7790862 | 0.87 | MEN1 (0.52) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7377201 | 0.85 | CTSL (0.51) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7782219 | 0.83 | AKR1C3 (0.53) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7782218 | 0.83 | AKR1C3 (0.53) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7787806 | 0.81 | AKR1C3 (0.52) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7782230 | 0.80 | AKR1C3 (0.50) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL7782228 | 0.80 | AKR1C3 (0.50) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL3904676 | 0.77 | CTSL (0.54) | MEN1KMT2ASMN1; SMN2CTSLMMP9 | |
| SCHEMBL7787778 | 0.77 | AKR1C3 (0.47) | HDAC8HDAC6MEN1KMT2AHDAC2 | |
| SCHEMBL3909187 | 0.76 | CTSL (0.47) | MEN1KMT2ASMN1; SMN2CTSLMMP9 |
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 |