Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PER2 | O15055 | 1/20 | 0.35 |
| ▸ | CRY1 | Q16526 | 1/20 | 0.35 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL10622844 | 0.78 | NR1H3 (0.45) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL14675962 | 0.77 | KMT2A (0.41) | ESR1NR3C2MEN1KMT2ACYP3A4 | |
| SCHEMBL6950233 | 0.71 | NR3C2 (0.39) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL4980683 | 0.70 | NR3C2 (0.41) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL3631040 | 0.69 | CA2 (0.39) | ESR1MEN1KMT2ACA12CA9 | |
| SCHEMBL2513199 | 0.69 | NR3C2 (0.44) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL1704542 | 0.69 | PKM (0.50) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL5012326 | 0.68 | ESR1 (0.41) | ESR1NR3C2MEN1KMT2ACA12 | |
| SCHEMBL171307 | 0.67 | ALDH1A1 (0.54) | NR3C2MEN1KMT2ACA12CA9 | |
| SCHEMBL3923472 | 0.66 | NR3C2 (0.41) | NR3C2MEN1KMT2ACA12CA9 |
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-1658076-B1 | ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES | 3M INNOVATIVE PROPERTIES CO (US) | 2013-03-06 | — | — | EP | disclosed |