Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | RORC | P51449 | 3/20 | 0.45 |
| ▸ | MMP3 | P08254 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10597177 | 0.85 | HSP90AA1 (0.55) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL12133562 | 0.84 | MMP3 (0.55) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL5070390 | 0.84 | HPGD (0.49) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL9511074 | 0.81 | HSP90AA1 (0.55) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL4432367 | 0.81 | KMT2A (0.38) | HSP90AA1HSD17B10CA1CA2CA9 | |
| SCHEMBL8294096 | 0.79 | CNR2 (0.53) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL14050550 | 0.79 | KMT2A (0.36) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL5966751 | 0.79 | HSP90AA1 (0.51) | HSP90AA1HPGDUSP2HSD17B10RORC | |
| SCHEMBL9840356 | 0.78 | MAPT (0.50) | HSP90AA1RORCMMP3CNR2 | |
| Phenylmethanesulfonic Acid SCHEMBL6669503 | 0.77 | TAAR1 (0.46) | HSP90AA1HPGDUSP2HSD17B10CA1 |
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-6596719-B1 | Manufacturing those compounds, pharmaceutical compositions containing one or more of those compounds as endothelin antagonists, and a method of treating a subject having a disorder involving endothelin with the compounds of the | ACTELIO PHARMACEUTICALS LTD. (CH) | 2003-07-22 | — | — | US | disclosed |