Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.45 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 6/20 | 0.44 |
| ▸ | MMP3 | P08254 | 6/20 | 0.44 |
| ▸ | MMP7 | P09237 | 5/20 | 0.44 |
| ▸ | MMP9 | P14780 | 5/20 | 0.44 |
| ▸ | MMP13 | P45452 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CCR4 | P51679 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2441912 | 0.91 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2441463 | 0.91 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2440433 | 0.91 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL4582127 | 0.91 | FKBP1A (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2438909 | 0.91 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL4460544 | 0.90 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2443915 | 0.90 | TRPA1 (0.45) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2442351 | 0.90 | MMP1 (0.48) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL12293803 | 0.90 | TRPA1 (0.45) | TRPA1FKBP1AMMP1MMP3MMP7 | |
| SCHEMBL2438744 | 0.90 | FKBP1A (0.47) | TRPA1FKBP1AMMP1MMP3MMP7 |
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-8017612-B2 | therapeutic agent for hepatitis C; R)-4-(4-trifluoromethyl-benzenesulfonyl)-piperazine-1,3-dicarboxylic acid 3-(4-isopropyl-benzylamide) 1-pyridin-4-ylamide; enzyme inhibitors | JAPAN TOBACCO INC. (JP) | 2011-09-13 | — | — | US | disclosed |
| US-8017612-B2 | therapeutic agent for hepatitis C; R)-4-(4-trifluoromethyl-benzenesulfonyl)-piperazine-1,3-dicarboxylic acid 3-(4-isopropyl-benzylamide) 1-pyridin-4-ylamide; enzyme inhibitors | JAPAN TOBACCO INC. (JP) | 2011-09-13 | — | — | US | disclosed |
| EP-2009004-A1 | NOVEL PIPERAZINE COMPOUND, AND USE THEREOF AS HCV POLYMERASE INHIBITOR | Japan Tobacco, Inc. (JP) | 2008-12-31 | — | — | EP | disclosed |