Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK2 | O95069 | 2/20 | 0.38 |
| ▸ | KCNK10 | P57789 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 2/20 | 0.35 |
| ▸ | PTGFR | P43088 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6833746 | 0.89 | KCNK2 (0.39) | KCNK2KCNK10ALDH1A1MAP2K1MPO | |
| SCHEMBL6818135 | 0.88 | RORC (0.34) | MAP2K1MPOKDM4EHSD17B10S1PR1 | |
| SCHEMBL6833974 | 0.78 | TAS2R14 (0.42) | MAP2K1MPOHTTGRIK1S1PR1 | |
| SCHEMBL6833954 | 0.78 | RORC (0.35) | MAP2K1MPOKDM4EHSD17B10S1PR1 | |
| SCHEMBL6710154 | 0.74 | GRIK1 (0.40) | ALDH1A1MAP2K1HTTGRIK1S1PR1 | |
| SCHEMBL6818553 | 0.74 | AKR1C2 (0.50) | KCNK2KCNK10PTGFRAKR1C2AKR1C1 | |
| SCHEMBL6818600 | 0.73 | TP53 (0.34) | MAP2K1MPOS1PR1S1PR3 | |
| SCHEMBL6821982 | 0.71 | TP53 (0.34) | S1PR1S1PR3 | |
| SCHEMBL6818246 | 0.71 | TP53 (0.34) | MAP2K1S1PR1S1PR3 | |
| SCHEMBL6822026 | 0.71 | EGLN2 (0.35) | MAP2K1MPOS1PR1S1PR3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004018428-A1 | ANTIBACTERIAL BENZOIC ACID DERIVATIVES | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-03-04 | — | — | WO | disclosed |