Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | GRK6 | P43250 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL6848185 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP3A4RECQLATMHDAC1 | |
| SCHEMBL6852489 | 0.81 | CYP17A1 (0.47) | ALDH1A1CYP3A4RECQLHDAC1HDAC2 | |
| SCHEMBL6852499 | 0.81 | CYP17A1 (0.47) | ALDH1A1CYP3A4RECQLHDAC1HDAC2 | |
| SCHEMBL6848095 | 0.81 | MKNK1 (0.57) | ALDH1A1CYP3A4HDAC1HDAC2HDAC3 | |
| SCHEMBL6848092 | 0.81 | MKNK1 (0.57) | ALDH1A1CYP3A4HDAC1HDAC2HDAC3 | |
| SCHEMBL9276381 | 0.77 | ALDH1A1 (0.62) | ALDH1A1CYP3A4RECQLKDM1AHDAC6 | |
| SCHEMBL9276383 | 0.77 | ALDH1A1 (0.62) | ALDH1A1CYP3A4RECQLKDM1AHDAC6 | |
| SCHEMBL14984804 | 0.76 | ALDH1A1 (0.53) | ALDH1A1CYP3A4RECQLHDAC1HDAC2 | |
| SCHEMBL5580490 | 0.76 | MGLL (0.53) | ALDH1A1CYP3A4RECQLHDAC1HDAC2 | |
| SCHEMBL5580493 | 0.76 | MGLL (0.53) | ALDH1A1CYP3A4RECQLHDAC1HDAC2 |
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 |