Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | MMP2 | P08253 | 3/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.41 |
| ▸ | MMP3 | P08254 | 2/20 | 0.41 |
| ▸ | MMP7 | P09237 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP13 | P45452 | 2/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL26426185 | 0.91 | TAAR1 (0.48) | ESR2TAAR1MAPTCYP17A1CYP3A4 | |
| SCHEMBL306546 | 0.79 | — | — | |
| SCHEMBL29909163 | 0.79 | — | — | |
| SCHEMBL16270804 | 0.78 | CNR1 (0.50) | ESR2TAAR1CNR2MEN1KMT2A | |
| SCHEMBL24910416 | 0.78 | TAAR1 (0.57) | ESR2TAAR1MMP2MMP1MMP3 | |
| Hydrochloric Acid SCHEMBL6465685 | 0.77 | RAPGEF4 (0.50) | TAAR1MMP2CA12CA9CA14 | |
| Isopropyl Alcohol SCHEMBL28078142 | 0.77 | CNR1 (0.51) | MEN1KMT2AMAPTCYP3A4 | |
| SCHEMBL28488286 | 0.75 | TSHR (0.48) | MMP8MMP14CA9CA14MEN1 | |
| SCHEMBL24786408 | 0.74 | TNKS2 (0.39) | ESR2TAAR1MEN1KMT2AMAPT | |
| SCHEMBL30288275 | 0.73 | TSHR (0.59) | MMP8MMP14CA9CA14MEN1 |
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-105764904-A | Aza-pyridone compounds and uses thereof | 艾丽奥斯生物制药有限公司 | 2016-07-13 | — | — | CN | disclosed |