Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 11/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.56 |
| ▸ | ITGB1 | P05556 | 5/20 | 0.54 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.54 |
| ▸ | ITGB7 | P26010 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMO | Q99835 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24862946 | 0.91 | CAPN1 (0.69) | CAPN1ITGB1ITGA4ITGB7POLB | |
| SCHEMBL24862860 | 0.84 | CAPN1 (0.57) | CAPN1POLBNPC1ALDH1A1GAA | |
| SCHEMBL24862862 | 0.84 | CAPN1 (0.57) | CAPN1NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL24863058 | 0.84 | CAPN1 (0.61) | CAPN1GAASMN1; SMN2 | |
| SCHEMBL24862961 | 0.81 | GFER (0.58) | GFERITGB1ITGA4ITGB7POLB | |
| SCHEMBL24862936 | 0.81 | CAPN1 (0.63) | CAPN1 | |
| SCHEMBL11581254 | 0.80 | GFER (0.57) | GFERITGB1ITGA4ITGB7POLB | |
| SCHEMBL11581256 | 0.80 | GFER (0.57) | GFERITGB1ITGA4ITGB7POLB | |
| SCHEMBL19248290 | 0.78 | CAPN1 (0.71) | CAPN1NPC1ALDH1A1GAA | |
| SCHEMBL23355169 | 0.77 | CAPN1 (0.58) | CAPN1ITGB1ITGA4ITGB7 |
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-3102193-B1 | ANTIBACTERIAL AGENTS: N(ALPHA)-AROYL-N-ARYL-PHENYLALANINAMIDES | UNIV RUTGERS (US) | 2023-01-11 | — | — | EP | disclosed |