Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.41 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23978642 | 0.85 | LNPEP (0.39) | LNPEPITGB1ITGA5POLB | |
| SCHEMBL24803388 | 0.81 | EPHX2 (0.46) | ALDH1A1 | |
| SCHEMBL30083836 | 0.81 | EPHX2 (0.46) | ALDH1A1 | |
| SCHEMBL26496578 | 0.81 | EPHX2 (0.46) | ALDH1A1 | |
| SCHEMBL23978981 | 0.79 | POLB (0.48) | CASP3POLBMAPTTACR1NPSR1 | |
| SCHEMBL30083853 | 0.79 | SLC6A9 (0.35) | LNPEPCASP3MAPTALDH1A1NTSR1 | |
| SCHEMBL24803374 | 0.79 | SLC6A9 (0.35) | LNPEPCASP3MAPTALDH1A1NTSR1 | |
| SCHEMBL23978717 | 0.79 | SLC6A9 (0.35) | LNPEPCASP3MAPTALDH1A1NTSR1 | |
| SCHEMBL23978763 | 0.78 | ITGB1 (0.46) | CASP3ITGB1ITGA5POLBMAPT | |
| SCHEMBL23978762 | 0.77 | ITGB2 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222789-A1 | INHIBITORS OF ALPHA 2 BETA 1 INTEGRIN AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-11-04 | — | — | WO | disclosed |