Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.54 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6877227 | 1.00 | MKNK1 (0.54) | MKNK1MKNK2CYP2A6ALDH1A1CYP3A4 | |
| SCHEMBL6877229 | 1.00 | MKNK1 (0.54) | MKNK1MKNK2CYP2A6ALDH1A1CYP3A4 | |
| SCHEMBL5959679 | 0.84 | MKNK1 (0.57) | MKNK1MKNK2CYP2A6ALDH1A1CYP3A4 | |
| SCHEMBL6877827 | 0.82 | ATM (0.39) | MKNK1MKNK2CYP2A6 | |
| SCHEMBL6877820 | 0.82 | ATM (0.39) | MKNK1MKNK2CYP2A6 | |
| SCHEMBL6877823 | 0.82 | ATM (0.39) | MKNK1MKNK2CYP2A6 | |
| SCHEMBL6879909 | 0.82 | HDAC1 (0.42) | KIF11LMNAMAPTSMN1; SMN2 | |
| SCHEMBL6879912 | 0.82 | HDAC1 (0.42) | KIF11LMNAMAPTSMN1; SMN2 | |
| SCHEMBL6879903 | 0.82 | HDAC1 (0.42) | KIF11LMNAMAPTSMN1; SMN2 | |
| SCHEMBL6850990 | 0.81 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6ALDH1A1CYP3A4 |
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 1 patent. 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 |