Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 4/20 | 0.45 |
| ▸ | CTSK | P43235 | 3/20 | 0.45 |
| ▸ | PAM | P19021 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | KDM4A | O75164 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.42 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5158237 | 1.00 | MAOB (0.49) | MAOBCTSSCTSKPAMNFKB1 | |
| SCHEMBL5638589 | 0.87 | MAPT (0.56) | EGFRPTPN11NPC1RAB9AALDH1A1 | |
| SCHEMBL5638591 | 0.87 | MAPT (0.56) | EGFRPTPN11NPC1RAB9AALDH1A1 | |
| SCHEMBL14499624 | 0.87 | MAPT (0.56) | EGFRPTPN11NPC1RAB9AALDH1A1 | |
| SCHEMBL5682372 | 0.85 | IDO1 (0.48) | CTSSCTSKPAMNFKB1NFKB2 | |
| SCHEMBL5678372 | 0.85 | IDO1 (0.48) | CTSSCTSKPAMNFKB1NFKB2 | |
| SCHEMBL5678361 | 0.85 | IDO1 (0.48) | CTSSCTSKPAMNFKB1NFKB2 | |
| SCHEMBL31602191 | 0.85 | MAOA (0.48) | MAOBIDO1EGFRCA12CA1 | |
| SCHEMBL31022932 | 0.85 | TTR (0.45) | KDM4ANPC1RAB9A | |
| SCHEMBL7453149 | 0.84 | NFKB1 (0.46) | CTSSCTSKNFKB1NFKB2RELA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1881002-A1 | HCV NS-3 serine protease inhibitors | Tibotec Pharmaceuticals Ltd. (IE) | 2008-01-23 | — | — | EP | disclosed |
| EP-1881001-A1 | HCV NS-3 serine protease inhibitors | Tibotec Pharmaceuticals Ltd. (IE) | 2008-01-23 | — | — | EP | disclosed |