Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | PTPRZ1 | P23471 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL23235884 | 0.82 | CA1 (0.42) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL19296679 | 0.78 | PIN1 (0.43) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL7850276 | 0.77 | RIPK1 (0.49) | CA1CA2EPHX2NR1H4CA7 | |
| SCHEMBL2250967 | 0.77 | EPHX2 (0.51) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL23254961 | 0.77 | TPSAB1 (0.61) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL22591171 | 0.76 | EPHX2 (0.42) | CA1CA2EPHX2NR1H4CA7 | |
| Hydrochloric Acid SCHEMBL23148228 | 0.76 | TPSAB1 (0.59) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL506307 | 0.75 | MTOR (0.54) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL2054822 | 0.75 | EPHX2 (0.50) | CA1CA2PIN1EPHX2NR1H4 | |
| SCHEMBL17586481 | 0.75 | EPHX2 (0.47) | CA1CA2PIN1EPHX2NR1H4 |
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-107001415-A | Cytotoxic and antimitotic compounds, and methods of use thereof | 酵活有限公司 | 2017-08-01 | — | — | CN | disclosed |