Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 6/20 | 0.76 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA3 | P07451 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 1/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.51 |
| ▸ | LCK | P06239 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29054932 | 0.82 | KCNA3 (0.62) | HDAC1CYP19A1CA12CA1CA9 | |
| SCHEMBL24522987 | 0.81 | HDAC1 (0.59) | HDAC1CYP19A1KDM4EHPGDALDH1A1 | |
| SCHEMBL3915220 | 0.81 | CYP19A1 (0.60) | HDAC1CYP19A1KDM4EHPGDALDH1A1 | |
| SCHEMBL24523121 | 0.81 | CYP19A1 (0.60) | HDAC1CYP19A1KDM4EHPGDALDH1A1 | |
| SCHEMBL30537341 | 0.79 | HDAC1 (0.58) | HDAC1KDM4EHPGD | |
| SCHEMBL29054811 | 0.79 | HDAC1 (0.58) | HDAC1KDM4EHPGD | |
| SCHEMBL3922052 | 0.79 | CYP2D6 (0.61) | HDAC1CYP19A1KDM4EHPGDALDH1A1 | |
| SCHEMBL29054860 | 0.79 | HDAC1 (0.66) | HDAC1CYP19A1CA12CA1CA9 | |
| SCHEMBL24522850 | 0.79 | HDAC1 (0.60) | HDAC1CYP19A1KDM4EHPGDALDH1A1 | |
| SCHEMBL24522836 | 0.78 | CYP19A1 (0.57) | HDAC1CYP19A1KDM4EHPGDALDH1A1 |
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-116621801-A | Coumarin derivative and preparation method and application thereof | 暨南大学 | 2023-08-22 | — | — | CN | disclosed |