Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC15A1 | P46059 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP14 | P50281 | 1/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6448984 | 0.81 | ABCB1 (0.43) | SLC15A1ABCB1ALDH1A1 | |
| SCHEMBL6454316 | 0.81 | ABCB1 (0.43) | SLC15A1ABCB1ALDH1A1 | |
| SCHEMBL9741196 | 0.81 | ABCB1 (0.43) | SLC15A1ABCB1ALDH1A1 | |
| SCHEMBL7268569 | 0.80 | ABCB1 (0.44) | SLC15A1ABCB1ALDH1A1 | |
| SCHEMBL8585981 | 0.79 | SLC15A1 (0.43) | SLC15A1ALDH1A1 | |
| SCHEMBL6449476 | 0.77 | LMNA (0.47) | SLC15A1ABCB1 | |
| SCHEMBL6446316 | 0.77 | LMNA (0.47) | SLC15A1ABCB1 | |
| SCHEMBL9741503 | 0.77 | LMNA (0.47) | SLC15A1ABCB1 | |
| SCHEMBL6448340 | 0.77 | LMNA (0.47) | SLC15A1ABCB1 | |
| SCHEMBL15263132 | 0.77 | SLC15A1 (0.47) | SLC15A1ABCB1ALDH1A1 |
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-0538396-A4 | — | — | 1994-04-13 | — | — | EP | disclosed |
| EP-0538396-A1 | INHIBITORS OF RETROVIRAL PROTEASES | SMITHKLINE BEECHAM CORPORATION (US) | 1993-04-28 | — | — | EP | disclosed |
| WO-1992000948-A1 | INHIBITORS OF RETROVIRAL PROTEASES | SMITHKLINE BEECHAM CORPORATION (US) | 1992-01-23 | — | — | WO | disclosed |