Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | BRS3 | P32247 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6229775 | 0.82 | CYP2D6 (0.45) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6878325 | 0.81 | CYP2D6 (0.49) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6878319 | 0.81 | CYP2D6 (0.49) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL11541937 | 0.80 | CYP2D6 (0.60) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6227552 | 0.79 | PIM2 (0.43) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6227545 | 0.79 | PIM2 (0.43) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6230889 | 0.78 | CYP2D6 (0.45) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6230887 | 0.78 | CYP2D6 (0.45) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6750 | 0.78 | KDM4E (0.53) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 | |
| SCHEMBL6276330 | 0.78 | CYP2D6 (0.47) | CYP2D6CYP2C9CYP19A1CYP2C19PIM2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1585775-A | 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials | ORTHO MCNEIL PHARM INC (US) | 2005-02-23 | — | — | CN | disclosed |