Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALPG | P10696 | 1/20 | 0.42 |
| ▸ | PDE6D | O43924 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL462620 | 0.95 | ESR1 (0.60) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL7095574 | 0.92 | ESR1 (0.68) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL1306747 | 0.88 | ESR1 (0.69) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| Hydrochloric Acid SCHEMBL10366282 | 0.87 | ESR1 (0.67) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL8971577 | 0.84 | ESR1 (0.59) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL4944410 | 0.84 | ESR1 (0.59) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL3833947 | 0.84 | ESR1 (0.59) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL14675947 | 0.83 | ESR1 (0.57) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| SCHEMBL11016233 | 0.83 | ESR1 (0.57) | ESR1CYP3A4CYP2C19CYP2C9HIF1A | |
| Hexadecane SCHEMBL5816538 | 0.83 | ESR1 (0.57) | ESR1CYP3A4CYP2C19CYP2C9HIF1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614614-A | ANTIBIOTICS, CHEMICAL INTERMEDIATES | ROUSSEL UCLAF (FR) | 1997-03-25 | — | — | US | disclosed |
| US-5527780-A | BACTERICIDES | ROUSSEL UCLAF (FR) | 1996-06-18 | — | — | US | disclosed |
| EP-0596802-B1 | Erythromycin derivatives, their process of preparation and their application as medicaments | ROUSSEL UCLAF (FR) | 1996-03-20 | — | — | EP | disclosed |
| EP-0596802-A1 | Erythromycin derivatives, their process of preparation and their application as medicaments | ROUSSEL UCLAF (FR) | 1994-05-11 | — | — | EP | disclosed |