Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | LMNA | P02545 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TCF4 | P15884 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | EDNRB | P24530 | 1/20 | 0.38 |
| ▸ | EDNRA | P25101 | 1/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8444252 | 0.94 | EDNRB (0.46) | EDNRBEDNRA | |
| SCHEMBL8445313 | 0.94 | EDNRB (0.44) | ALDH1A1LMNASMN1; SMN2HPGDPKM | |
| SCHEMBL8441557 | 0.91 | ALDH1A1 (0.42) | ALDH1A1LMNASMN1; SMN2HPGDPKM | |
| SCHEMBL8443151 | 0.90 | ALDH1A1 (0.41) | ALDH1A1LMNASMN1; SMN2HPGDMAPT | |
| SCHEMBL8441685 | 0.85 | EDNRA (0.46) | ALDH1A1LMNASMN1; SMN2HPGDMAPT | |
| SCHEMBL8444251 | 0.84 | NPC1 (0.37) | ALDH1A1LMNASMN1; SMN2HPGDMAPT | |
| SCHEMBL8441932 | 0.84 | EDNRA (0.45) | EDNRBEDNRA | |
| SCHEMBL8445360 | 0.84 | ALDH1A1 (0.42) | ALDH1A1LMNASMN1; SMN2HPGDMAPT | |
| SCHEMBL8441928 | 0.83 | ALDH1A1 (0.36) | ALDH1A1LMNASMN1; SMN2HPGDMAPT | |
| SCHEMBL8444952 | 0.83 | LMNA (0.37) | ALDH1A1LMNASMN1; SMN2HPGDMAPT |
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-5962682-A | Aryl- and hetaryl-sulfonamide derivatives, their preparation and their use as endothelin antagonists | HOFFMANN-LA ROCHE INC. (US) | 1999-10-05 | — | — | US | disclosed |