Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | RARB | P10826 | 2/20 | 0.49 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.49 |
| ▸ | RARG | P13631 | 1/20 | 0.45 |
| ▸ | ADH5 | P11766 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31748479 | 0.85 | ALDH1A1 (0.49) | ALDH1A1RARBRARGADH5KMO | |
| SCHEMBL2731718 | 0.85 | ALDH1A1 (0.49) | ALDH1A1RARBRARGADH5KMO | |
| SCHEMBL31097014 | 0.85 | KMO (0.53) | ALDH1A1RARBRARGKMOPLA2G2A | |
| SCHEMBL22067719 | 0.83 | ALDH1A1 (0.50) | ALDH1A1RARBRARG | |
| SCHEMBL14740028 | 0.81 | MAPT (0.46) | ALDH1A1RARB | |
| SCHEMBL2963261 | 0.80 | ALDH1A1 (0.61) | ALDH1A1RARBRARGADH5PLA2G2A | |
| SCHEMBL8295573 | 0.78 | NOTUM (0.50) | ALDH1A1RARBNOTUM | |
| SCHEMBL16645310 | 0.77 | ALDH1A1 (0.57) | ALDH1A1RARBRARGADH5KMO | |
| SCHEMBL23809467 | 0.76 | XDH (0.49) | — | |
| SCHEMBL18603139 | 0.76 | ALDH1A1 (0.49) | ALDH1A1RARBRARGADH5KMO |
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-2012056478-A1 | OXAZOLE AND ISOXAZOLE CRAC MODULATORS | LUPIN LIMITED (IN) | 2012-05-03 | — | — | WO | disclosed |