Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 1/20 | 0.53 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 7/20 | 0.43 |
| ▸ | CA2 | P00918 | 7/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15601806 | 0.86 | PRSS1 (0.51) | PRSS1TPSAB1CA1CA2ALDH1A1 | |
| SCHEMBL316882 | 0.85 | ALDH1A1 (0.55) | PRSS1TPSAB1ALDH1A1ABCB1MAOB | |
| SCHEMBL15592194 | 0.85 | MEN1 (0.51) | PRSS1TPSAB1CA1CA2MAOB | |
| SCHEMBL21896174 | 0.84 | PRSS1 (0.49) | PRSS1TPSAB1PHLPP2ALDH1A1ABCB1 | |
| Hydrochloric Acid SCHEMBL6444517 | 0.84 | ALDH1A1 (0.53) | PRSS1TPSAB1ALDH1A1ABCB1MAOB | |
| SCHEMBL25567572 | 0.81 | PHLPP2 (0.49) | PRSS1TPSAB1PHLPP2ALDH1A1ABCB1 | |
| SCHEMBL26560436 | 0.81 | PRSS1 (0.47) | PRSS1TPSAB1PHLPP2ALDH1A1ABCB1 | |
| SCHEMBL20435506 | 0.80 | PRSS1 (0.44) | PRSS1TPSAB1PHLPP2ALDH1A1ABCB1 | |
| SCHEMBL20434505 | 0.80 | TPSAB1 (0.46) | PRSS1TPSAB1PHLPP2ALDH1A1ABCB1 | |
| SCHEMBL21069881 | 0.80 | ALDH1A1 (0.49) | PRSS1TPSAB1ALDH1A1ABCB1MAOB |
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-3424941-A1 | PRODUCTION METHOD FOR NONCYCLIC PEPTIDE-NUCLEIC ACID COMPLEX HAVING, AT N-TERMINAL, AMINO ACID WITH THIOL GROUP NEAR AMINO GROUP, LIBRARY THEREOF, AND CYCLIC PEPTIDE-NUCLEIC ACID COMPLEX LIBRARY DERIVED FROM SAME | Chugai Seiyaku Kabushiki Kaisha (JP) | 2019-01-09 | — | — | EP | disclosed |