Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.68 |
| ▸ | CA1 | P00915 | 5/20 | 0.68 |
| ▸ | CA2 | P00918 | 5/20 | 0.68 |
| ▸ | CA7 | P43166 | 5/20 | 0.68 |
| ▸ | CA9 | Q16790 | 5/20 | 0.68 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.68 |
| ▸ | EGFR | P00533 | 2/20 | 0.51 |
| ▸ | ESR1 | P03372 | 5/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | ESRRG | P62508 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9017656 | 0.87 | TSHR (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4397432 | 0.84 | CA12 (0.65) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29457603 | 0.81 | CA12 (1.00) | CA12CA1CA2CA7CA9 | |
| SCHEMBL39259 | 0.81 | CA12 (1.00) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25963027 | 0.81 | CA12 (0.64) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7592080 | 0.80 | ESR1 (0.77) | CA12CA1CA2CA7CA9 | |
| SCHEMBL13609957 | 0.79 | CA12 (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL95477 | 0.79 | CA1 (0.58) | CA12CA1CA2CA7CA9 | |
| SCHEMBL14301487 | 0.79 | ESR1 (0.55) | CA12CA1CA2CA7CA9 | |
| SCHEMBL4384821 | 0.78 | HSD17B10 (0.53) | 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 |
|---|---|---|---|---|---|---|---|
| US-5550205-A | MELT-POLYCONDENSING AROMATIC DIHYDROXY COMPOUNDS AND CARBONIC DIESTERS IN THE PRESENCE OF AN ALKALI METAL OR ALKALINE EARTH METAL CATALYST | GENERAL ELECTRIC COMPANY (US) | 1996-08-27 | — | — | US | disclosed |