Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 2/20 | 0.47 |
| ▸ | CTSG | P08311 | 2/20 | 0.47 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.47 |
| ▸ | CMA1 | P23946 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CASP2 | P42575 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14560932 | 0.83 | PHF8 (0.39) | PRSS1CTSGCTRB1CMA1 | |
| SCHEMBL13297301 | 0.80 | PRSS1 (0.32) | PRSS1CTSGCTRB1CMA1 | |
| SCHEMBL20871381 | 0.80 | SMN1; SMN2 (0.33) | MEN1KMT2ACYP1A2CYP2C19CYP3A4 | |
| SCHEMBL13297312 | 0.76 | — | — | |
| SCHEMBL10076038 | 0.75 | KDM4E (0.34) | CTRB1ALDH1A1 | |
| SCHEMBL19988829 | 0.74 | HDAC3 (0.44) | PRSS1CTSGCTRB1CMA1HDAC3 | |
| SCHEMBL13315773 | 0.73 | PRSS1 (0.31) | PRSS1CTSGCTRB1CMA1 | |
| SCHEMBL13297304 | 0.73 | — | — | |
| SCHEMBL13297296 | 0.73 | PIK3CD (0.30) | — | |
| SCHEMBL14571737 | 0.70 | PRSS1 (0.42) | PRSS1CTSGCTRB1CMA1HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3235836-A1 | POLYMER | Sumitomo Chemical Company, Ltd. (JP) | 2017-10-25 | — | — | EP | disclosed |