Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 5/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | LOX | P28300 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 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 | |
|---|---|---|---|---|
| SCHEMBL4734280 | 0.86 | PTGS2 (0.53) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL28134928 | 0.83 | PTGS2 (0.44) | PTGS2PTGS1CA2CA9CA1 | |
| SCHEMBL21590167 | 0.76 | HDAC3 (0.47) | PTGS2CA12CA2CA9CA1 | |
| SCHEMBL1045784 | 0.76 | ALDH1A1 (0.50) | PTGS2PTGS1ALDH1A1KDM4EMAOA | |
| SCHEMBL8597605 | 0.76 | HDAC7 (0.45) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL29588197 | 0.76 | HDAC7 (0.45) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL31453311 | 0.76 | ALDH1A1 (0.41) | PTGS2PTGS1CA12CA2CA9 | |
| SCHEMBL28327116 | 0.75 | CA2 (0.46) | CA12CA2CA9CA1CA6 | |
| Hydrochloric Acid SCHEMBL5795789 | 0.75 | PTGS2 (0.50) | PTGS2PTGS1MAOALOXL2 | |
| SCHEMBL8552729 | 0.75 | CA2 (0.53) | PTGS2PTGS1CA12CA2CA9 |
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-106496373-B | Catalytic component and its preparation and application for olefinic polymerization | 中国石油化工股份有限公司 | 2019-09-27 | — | — | CN | disclosed |