Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.59 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.59 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.59 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.59 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.59 |
| ▸ | PGR | P06401 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.54 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.54 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.54 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | MMP13 | P45452 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6762244 | 0.87 | TXNRD1 (0.59) | L3MBTL1ALDH1A1HSPD1PTPN2PTPN1 | |
| SCHEMBL1791900 | 0.85 | MEN1 (0.72) | L3MBTL1ALDH1A1HSPD1PTPN2PTPN1 | |
| SCHEMBL8311699 | 0.83 | HSPD1 (0.62) | L3MBTL1ALDH1A1HSPD1PTPN2PTPN1 | |
| SCHEMBL8541050 | 0.80 | PIK3CD (0.57) | ALDH1A1HSPD1PTPN2PTPN1PTPN5 | |
| SCHEMBL8313917 | 0.80 | POLB (0.58) | ALDH1A1HSPD1PTPN2PTPN1PTPN5 | |
| SCHEMBL8315398 | 0.80 | TXNRD1 (0.56) | L3MBTL1HSPD1PTPN2PTPN1PTPN5 | |
| SCHEMBL8311524 | 0.79 | MEN1 (0.56) | L3MBTL1KMT2ATXNRD1TXNRD3TXNRD2 | |
| SCHEMBL31700541 | 0.78 | HSPD1 (0.64) | L3MBTL1ALDH1A1HSPD1PTPN2PTPN1 | |
| SCHEMBL4101284 | 0.77 | PGR (0.78) | ALDH1A1PGRKMT2ACA1CA2 | |
| SCHEMBL10090764 | 0.77 | ALDH1A1 (0.64) | L3MBTL1ALDH1A1HSPD1PTPN2PTPN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733626-B1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GMBH (DE) | 1999-01-13 | — | — | EP | disclosed |
| US-5726194-A | Endothelin receptor antagonists | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-03-10 | — | — | US | disclosed |
| EP-0733626-A1 | N-(Benzofuranazyl)-arylsulphonamides and their analogues useful as endothelin-receptor-antagonists | MERCK PATENT GmbH (DE) | 1996-09-25 | — | — | EP | disclosed |