Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 3/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 3/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8522671 | 0.75 | ITGB1 (0.35) | ITGB1ITGA4ITGB7 | |
| SCHEMBL7568864 | 0.72 | EDNRA (0.45) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8441879 | 0.67 | FABP4 (0.34) | ALDH1A1LMNA | |
| SCHEMBL7575836 | 0.65 | KDM4E (0.33) | ITGB1ITGA4ALDH1A1 | |
| SCHEMBL7567984 | 0.64 | L3MBTL1 (0.44) | ADRA1DADRA1AADRA1BALDH1A1SMN1; SMN2 | |
| SCHEMBL11250934 | 0.63 | CHRNB4 (0.40) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7567621 | 0.60 | BCHE (0.34) | — | |
| SCHEMBL19844425 | 0.60 | ADRA2A (0.33) | ALDH1A1LMNA | |
| SCHEMBL12263820 | 0.60 | ESR1 (0.38) | ITGB1ITGA4ALDH1A1SMN1; SMN2 | |
| SCHEMBL10442861 | 0.59 | HPGD (0.37) | ITGB1ITGA4ALDH1A1 |
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 |