Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | TYMP | P19971 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL8001605 | 0.83 | LMNA (0.42) | CYP3A4CYP2D6OPRK1LMNATHRB | |
| SCHEMBL7998127 | 0.83 | HRH1 (0.36) | LMNAKDM4EKMT2AHSP90AA1HSP90B1 | |
| SCHEMBL7984571 | 0.82 | CYP3A4 (0.43) | CYP3A4CYP2D6OPRK1LMNATHRB | |
| SCHEMBL7998436 | 0.81 | CYP3A4 (0.42) | CYP3A4CYP2D6OPRK1LMNATHRB | |
| SCHEMBL7997717 | 0.80 | NPSR1 (0.47) | CYP3A4CYP2D6OPRK1LMNACA12 | |
| SCHEMBL7997727 | 0.77 | CYP3A4 (0.39) | CYP3A4CYP2D6OPRK1LMNACA12 | |
| SCHEMBL7997732 | 0.77 | CYP3A4 (0.39) | CYP3A4CYP2D6OPRK1LMNACA12 | |
| SCHEMBL7995693 | 0.76 | KMT2A (0.38) | CYP3A4CYP2D6OPRK1LMNACYP2C19 | |
| SCHEMBL8001628 | 0.76 | GRM2 (0.41) | CYP3A4CYP2D6OPRK1TYMPKDM4E | |
| SCHEMBL13942276 | 0.74 | HSP90AA1 (0.46) | CYP3A4CYP2D6OPRK1LMNATHRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001034578-A1 | COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY | ASTRAZENECA AB (SE) | 2001-05-17 | — | — | WO | disclosed |