Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7461055 | 0.98 | SMN1; SMN2 (0.40) | KMT2ASMN1; SMN2CYP3A4CYP2C19OPRK1 | |
| SCHEMBL8795319 | 0.92 | SMN1; SMN2 (0.38) | KMT2ASMN1; SMN2CYP3A4CYP2C19MEN1 | |
| SCHEMBL8796414 | 0.92 | ALDH1A1 (0.38) | KMT2ASMN1; SMN2CYP3A4CYP2C19OPRK1 | |
| SCHEMBL7461153 | 0.88 | F2 (0.38) | KMT2AOPRK1CA12CA7CA9 | |
| SCHEMBL7464516 | 0.87 | PSMB5 (0.39) | KMT2AOPRK1MEN1F2 | |
| SCHEMBL6708356 | 0.87 | MEN1 (0.41) | KMT2AOPRK1CA12CA7CA9 | |
| SCHEMBL7460738 | 0.86 | ALDH1A1 (0.41) | SMN1; SMN2OPRK1BACE1LIMK2F2 | |
| SCHEMBL6708363 | 0.85 | ITGA4 (0.40) | KMT2ASMN1; SMN2CYP3A4CYP2C19OPRK1 | |
| SCHEMBL6762938 | 0.82 | MEN1 (0.39) | KMT2AOPRK1CA12CA7CA9 | |
| SCHEMBL8795656 | 0.81 | LMNA (0.38) | KMT2AMEN1F2 |
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-0810209-A2 | Alpha - and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors | G.D. SEARLE & CO. (US) | 1997-12-03 | — | — | EP | claimed |
| EP-0810209-B1 | Alpha - and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors | SEARLE & CO (US) | 2002-06-05 | — | — | EP | disclosed |
| EP-0810209-A2 | Alpha - and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors | G.D. SEARLE & CO. (US) | 1997-12-03 | — | — | EP | disclosed |