Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | SCN4A | P35499 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6881876 | 1.00 | KEAP1 (0.50) | KEAP1KMT2ACYP19A1SCN4AALDH1A1 | |
| SCHEMBL6249939 | 0.78 | KEAP1 (0.55) | KEAP1KMT2ACYP19A1SCN4AMKNK1 | |
| SCHEMBL6879590 | 0.75 | KEAP1 (0.51) | KEAP1KMT2ACYP19A1SCN4AALDH1A1 | |
| SCHEMBL6879585 | 0.75 | KEAP1 (0.51) | KEAP1KMT2ACYP19A1SCN4AALDH1A1 | |
| SCHEMBL28737914 | 0.75 | KEAP1 (0.47) | KEAP1KMT2ACYP19A1SCN4AMKNK1 | |
| SCHEMBL6850634 | 0.75 | KEAP1 (0.47) | KEAP1KMT2ACYP19A1SCN4AMKNK1 | |
| SCHEMBL948672 | 0.74 | KEAP1 (0.58) | KEAP1KMT2ACYP19A1SCN4AALDH1A1 | |
| SCHEMBL9276381 | 0.72 | ALDH1A1 (0.62) | KMT2ACYP19A1ALDH1A1CYP3A4RECQL | |
| SCHEMBL9276383 | 0.72 | ALDH1A1 (0.62) | KMT2ACYP19A1ALDH1A1CYP3A4RECQL | |
| SCHEMBL15885670 | 0.71 | KEAP1 (0.64) | KEAP1KMT2ACYP19A1SCN4AALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6825170-B2 | ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2004-11-30 | — | — | US | disclosed |
| EP-1453847-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003050132-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2003-06-19 | — | — | WO | disclosed |