Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.91 |
| ▸ | CA1 | P00915 | 5/20 | 0.91 |
| ▸ | CA2 | P00918 | 5/20 | 0.91 |
| ▸ | CA7 | P43166 | 5/20 | 0.91 |
| ▸ | CA9 | Q16790 | 5/20 | 0.91 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.91 |
| ▸ | ESR1 | P03372 | 4/20 | 0.91 |
| ▸ | AKR1B10 | O60218 | 4/20 | 0.91 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.91 |
| ▸ | TYR | P14679 | 3/20 | 0.91 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.91 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.91 |
| ▸ | PKM | P14618 | 2/20 | 0.91 |
| ▸ | CA3 | P07451 | 2/20 | 0.91 |
| ▸ | CA4 | P22748 | 2/20 | 0.91 |
| ▸ | CA6 | P23280 | 2/20 | 0.91 |
| ▸ | DPP4 | P27487 | 2/20 | 0.91 |
| ▸ | CA5A | P35218 | 2/20 | 0.91 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.91 |
| ▸ | F3 | P13726 | 2/20 | 0.65 |
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 | |
|---|---|---|---|---|
| Coumaric Acid SCHEMBL39106 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL20702657 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL434720 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL6333097 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL6333102 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL43601 | 0.96 | ESR1 (1.00) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL17443295 | 0.94 | CA12 (0.88) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL7871865 | 0.93 | ESR1 (0.95) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL6328280 | 0.93 | ESR1 (0.95) | CA12CA1CA2CA7CA9 | |
| Coumaric Acid SCHEMBL7040450 | 0.93 | ESR1 (0.95) | CA12CA1CA2CA7CA9 |
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-2008083974-A1 | ACTIVE SUBSTANCE COMBINATION | ISDIN S.A. (ES) | 2008-07-17 | — | — | WO | disclosed |