Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.47 |
| ▸ | ACHE | P22303 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | USP18 | Q9UMW8 | 2/20 | 0.42 |
| ▸ | UCHL5 | Q9Y5K5 | 2/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17693740 | 0.95 | CASP3 (0.56) | CASP3HDAC8ACHEMAPTMEN1 | |
| SCHEMBL17693764 | 0.87 | CASP3 (0.48) | CASP3HDAC8ACHEMAPTALDH1A1 | |
| SCHEMBL19954694 | 0.84 | HDAC8 (0.63) | HDAC8ACHEMAPTMEN1ALDH1A1 | |
| SCHEMBL17693760 | 0.83 | CASP3 (0.53) | CASP3ACHEMAPTMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL23877810 | 0.82 | HDAC8 (0.64) | HDAC8ACHEMAPTMEN1ALDH1A1 | |
| SCHEMBL25004153 | 0.81 | DPP4 (0.44) | CASP3HDAC8MAPTRAB9AUSP18 | |
| SCHEMBL25004554 | 0.81 | DPP4 (0.44) | CASP3HDAC8MAPTRAB9AUSP18 | |
| SCHEMBL25003481 | 0.78 | CASP3 (0.50) | CASP3ACHEMAPTMEN1RAB9A | |
| SCHEMBL19954682 | 0.78 | CASP3 (0.50) | CASP3ACHEMAPTMEN1ALDH1A1 | |
| SCHEMBL17693738 | 0.78 | CASP3 (0.58) | CASP3ACHEMAPTRAB9AUSP18 |
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-9913834-B2 | Bis-benzylidine piperidone proteasome inhibitor with anticancer activity | THE JOHNS HOPKINS UNIVERSITY (US) | 2018-03-13 | — | — | US | disclosed |