Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 2/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 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 | |
|---|---|---|---|---|
| SCHEMBL2175919 | 0.88 | XDH (0.50) | XDHGAATSHRNR1H4LMNA | |
| SCHEMBL18304472 | 0.85 | ALDH1A1 (0.44) | TSHRPRKCAPRKCDCYP4F2CYP4A11 | |
| SCHEMBL18304538 | 0.85 | NR1H4 (0.47) | XDHTSHRNR1H4RARARARB | |
| SCHEMBL10068719 | 0.83 | PRKCA (0.47) | XDHGAASLC7A5PRKCAPRKCD | |
| SCHEMBL1794516 | 0.82 | ALDH1A1 (0.45) | XDHGAASLC7A5PRKCAPRKCD | |
| SCHEMBL2177328 | 0.82 | NR1H4 (0.50) | XDHGAATSHRNR1H4LMNA | |
| SCHEMBL2650533 | 0.82 | CA12 (0.58) | XDHGAATSHRNR1H4LMNA | |
| SCHEMBL2255610 | 0.81 | CA1 (0.48) | XDHGAATSHRSLC7A5PRKCA | |
| SCHEMBL31371222 | 0.81 | CA1 (0.48) | XDHGAATSHRSLC7A5PRKCA | |
| SCHEMBL18304457 | 0.81 | XDH (0.36) | XDHNR1H4ALDH1A1MAPTRARA |
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-2012019428-A1 | BENZOHYDROL DERIVATIVES, A PREPARATION PROCESS AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |