Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | WDR5 | P61964 | 1/20 | 0.49 |
| ▸ | FADS1 | O60427 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL315808 | 0.94 | TP53 (0.59) | TP53CYP3A4KMT2AALOX15MAPK1 | |
| SCHEMBL30167806 | 0.94 | TP53 (0.59) | TP53CYP3A4KMT2AALOX15MAPK1 | |
| 1,3-Diethoxybenzene SCHEMBL1100167 | 0.87 | TP53 (0.71) | TP53CYP3A4KMT2AMAPK1CYP1A2 | |
| Acetaldehyde SCHEMBL27974152 | 0.83 | KMT2A (0.53) | TP53CYP3A4KMT2AALOX15MAPK1 | |
| SCHEMBL13064194 | 0.81 | LTA4H (0.58) | TP53CYP3A4KMT2AMAPK1CYP1A2 | |
| SCHEMBL9488001 | 0.80 | TP53 (0.63) | TP53CYP3A4KMT2AMAPK1CYP1A2 | |
| SCHEMBL24854715 | 0.79 | KMT2A (0.51) | TP53CYP3A4KMT2AALOX15MAPK1 | |
| 1-Methoxy-3-Ethoxybenzene SCHEMBL1068417 | 0.78 | CYP3A4 (0.61) | TP53CYP3A4KMT2AMAPK1CYP1A2 | |
| SCHEMBL196962 | 0.78 | KMT2A (0.68) | TP53KMT2AMAPK1CYP2D6WDR5 | |
| SCHEMBL29997393 | 0.77 | TAAR1 (0.53) | TP53KMT2AALOX15SMN1; SMN2NQO1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1032581-B1 | CHEMICAL SYNTHESIS OF 6-O-ALKYL ERYTHROMYCIN A | ABBOTT LAB (US) | 2004-03-31 | — | — | EP | disclosed |
| EP-1032581-A1 | CHEMICAL SYNTHESIS OF 6-O-ALKYL ERYTHROMYCIN A | Abbott Laboratories (US) | 2000-09-06 | — | — | EP | disclosed |
| WO-1999025723-A1 | CHEMICAL SYNTHESIS OF 6-O-ALKYL ERYTHROMYCIN A | ABBOTT LABORATORIES (US) | 1999-05-27 | — | — | WO | disclosed |
| US-5852180-A | Chemical synthesis of 6-O-alkyl erythromycin A | ABBOTT LABORATORIES (US) | 1998-12-22 | — | — | US | disclosed |