Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | CCR5 | P51681 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20601731 | 0.79 | EGFR (0.32) | EGFRCCR1RAB9ACCR5ALDH1A1 | |
| SCHEMBL14558319 | 0.72 | CCR1 (0.37) | EGFRCCR1RAB9ACCR5ALDH1A1 | |
| Hydrochloric Acid SCHEMBL20601737 | 0.68 | SMN1; SMN2 (0.38) | RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL2395774 | 0.67 | ALDH1A1 (0.53) | POLBEGFRCCR1RAB9ACCR5 | |
| SCHEMBL29956425 | 0.67 | ALDH1A1 (0.53) | POLBEGFRCCR1RAB9ACCR5 | |
| SCHEMBL21645429 | 0.66 | KDM4E (0.37) | POLB | |
| SCHEMBL15061194 | 0.66 | KDM4E (0.33) | EGFRCCR1RAB9ACCR5 | |
| SCHEMBL20415576 | 0.66 | RORC (0.33) | POLBEGFRCCR1RAB9ACCR5 | |
| Hydrochloric Acid SCHEMBL21645442 | 0.65 | KDM4E (0.36) | POLB | |
| SCHEMBL190651 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3644990-A1 | 5-(PYRIDIN-3-YL)OXAZOLE ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR | Merck Sharp & Dohme Corp. (US) | 2020-05-06 | — | — | EP | disclosed |
| WO-2019005589-A1 | 5-(PYRIDIN-3-YL)OXAZOLE ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR | MERCK SHARP & DOHME CORP. (US) | 2019-01-03 | — | — | WO | disclosed |