Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL988375 | 0.82 | PTGS1 (0.39) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL11615938 | 0.81 | PTGS1 (0.38) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL10425006 | 0.78 | HDAC4 (0.37) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL3526537 | 0.77 | — | — | |
| SCHEMBL9623341 | 0.76 | PTGS1 (0.36) | HDAC4HDAC2HDAC8HDAC6KMT2A | |
| Hydrochloric Acid SCHEMBL21879605 | 0.75 | KDM1A (0.33) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL4734441 | 0.75 | GSTP1 (0.37) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL4734438 | 0.75 | GSTP1 (0.37) | HDAC4HDAC2HDAC8HDAC6SMN1; SMN2 | |
| SCHEMBL3986854 | 0.75 | HDAC2 (0.36) | EPHX1HDAC4HDAC2HDAC8HDAC6 | |
| SCHEMBL10394017 | 0.74 | KDM4E (0.37) | SMN1; SMN2ALDH1A1KMT2AMAPK1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109553641-B | Novel pincer-like metal complex and application thereof | 中国科学院上海有机化学研究所 | 2023-05-12 | — | — | CN | disclosed |
| CN-109553641-A | Novel pincer metal complex and its application | 中国科学院上海有机化学研究所 | 2019-04-02 | — | — | CN | disclosed |