Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 8/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.42 |
| ▸ | ITK | Q08881 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | OGFRL1 | Q5TC84 | 3/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | APLNR | P35414 | 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 | |
|---|---|---|---|---|
| SCHEMBL16901737 | 0.87 | EGFR (0.51) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16895977 | 0.87 | EGFR (0.52) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16901733 | 0.85 | EGFR (0.51) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16896032 | 0.85 | EGFR (0.50) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16896031 | 0.85 | EGFR (0.50) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16895679 | 0.83 | EGFR (0.47) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16895682 | 0.83 | EGFR (0.47) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16901734 | 0.82 | EGFR (0.47) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16895488 | 0.81 | EGFR (0.47) | EGFRCYP3A4CYP2C9CYP2D6USP30 | |
| SCHEMBL16895489 | 0.81 | EGFR (0.47) | EGFRCYP3A4CYP2C9CYP2D6USP30 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2773635-B1 | COMPOUNDS AND COMPOSITIONS FOR MODULATING EGFR ACTIVITY | NOVARTIS AG (CH) | 2017-08-02 | — | — | EP | disclosed |