Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 6/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 6/20 | 0.54 |
| ▸ | RELA | Q04206 | 6/20 | 0.54 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL6058662 | 1.00 | NFKB1 (0.54) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL6058659 | 1.00 | NFKB1 (0.54) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL3906310 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL31454839 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL31454797 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL4998586 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL5016759 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL13628664 | 0.86 | NFKB1 (0.51) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL5545237 | 0.85 | NFKB1 (0.50) | NFKB1NFKB2RELAKDM1ABTK | |
| SCHEMBL14511588 | 0.85 | NFKB1 (0.50) | NFKB1NFKB2RELAKDM1ABTK |
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 |
|---|---|---|---|---|---|---|---|
| US-7071175-B1 | Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors | ASTRAZENECA AB (SE) | 2006-07-04 | — | — | US | disclosed |
| EP-1180098-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000066557-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 2000-11-09 | — | — | WO | disclosed |