Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MELK | Q14680 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL6869984 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MMP2MMP12MELKHRH3 | |
| SCHEMBL6227667 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MMP2MMP12MELKHRH3 | |
| SCHEMBL6852735 | 0.81 | ALDH1A1 (0.41) | ALDH1A1MMP2MMP12MELKHRH3 | |
| SCHEMBL7841866 | 0.78 | MAPK14 (0.44) | ALDH1A1MMP2MMP12MELKMAPK14 | |
| SCHEMBL6847737 | 0.77 | HDAC4 (0.35) | ALDH1A1HDAC4HDAC3HDAC1HDAC7 | |
| SCHEMBL6850648 | 0.76 | ALDH1A1 (0.57) | ALDH1A1MMP2MMP12MELKNPC1 | |
| SCHEMBL103643 | 0.76 | MMP2 (0.47) | ALDH1A1MMP2MMP12MELKMAPK14 | |
| SCHEMBL9672111 | 0.75 | MMP2 (0.50) | ALDH1A1MMP2MMP12MELKHRH3 | |
| SCHEMBL6879614 | 0.73 | HDAC4 (0.36) | ALDH1A1HDAC4HDAC3HDAC1HDAC7 | |
| SCHEMBL6446069 | 0.73 | MMP2 (0.55) | ALDH1A1MMP2MMP12MELKHRH3 |
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 |