Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 10/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | KLK7 | P49862 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GNRHR | P30968 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6658792 | 0.89 | EDNRB (0.51) | EDNRBKDM4EALDH1A1HPGDTSHR | |
| SCHEMBL6659388 | 0.83 | EDNRB (0.53) | EDNRBKDM4EALDH1A1HPGDTSHR | |
| SCHEMBL6315607 | 0.82 | EDNRB (0.54) | EDNRBKDM4EALDH1A1HPGDTSHR | |
| SCHEMBL8703164 | 0.78 | EDNRB (0.63) | EDNRB | |
| SCHEMBL6313381 | 0.77 | EDNRB (0.55) | EDNRBKDM4EALDH1A1HPGDTSHR | |
| SCHEMBL8700801 | 0.77 | EDNRB (0.68) | EDNRB | |
| SCHEMBL8696580 | 0.74 | ALDH1A1 (0.46) | KDM4EALDH1A1HPGDTSHRKMT2A | |
| SCHEMBL8698304 | 0.70 | EDNRB (0.75) | EDNRB | |
| SCHEMBL8552678 | 0.67 | EDNRB (0.43) | EDNRB | |
| SCHEMBL8552610 | 0.66 | EDNRB (0.46) | EDNRBKDM4EALDH1A1KMT2AHSD17B10 |
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-1998042709-A1 | ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 1998-10-01 | — | — | WO | disclosed |