Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA3 | P07451 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.53 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.45 |
| ▸ | ESR1 | P03372 | 5/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | P4HB | P07237 | 1/20 | 0.39 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17655674 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL29310046 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL17902710 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL19114376 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL13538934 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL14943982 | 0.86 | ALDH1A1 (0.41) | CA2CA12CA9ESR1ESR2 | |
| SCHEMBL10160323 | 0.80 | NOS3 (0.50) | CA2CA12CA3CA6CA9 | |
| SCHEMBL4078028 | 0.75 | CYP19A1 (0.68) | CA2CA12CA3CA6CA9 | |
| SCHEMBL3767098 | 0.74 | CA12 (0.73) | CA2CA12CA3CA6CA9 | |
| SCHEMBL3767100 | 0.74 | CA12 (0.73) | CA2CA12CA3CA6CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3138881-B1 | THERMALLY CONDUCTIVE POLYMER COMPOSITION AND THERMALLY CONDUCTIVE MOLDED OBJECT | NITTO DENKO CORP (JP) | 2020-12-09 | — | — | EP | disclosed |