Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 5/20 | 0.40 |
| ▸ | ENPP1 | P22413 | 4/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.40 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5685915 | 0.77 | ALDH1A1 (0.56) | CA1CA2CA9CA12MMP1 | |
| SCHEMBL27716097 | 0.76 | MAPT (0.41) | CA1CA2CA9CA12MAPT | |
| SCHEMBL8843455 | 0.74 | F2 (0.50) | CA1CA2MMP1ALDH1A1 | |
| SCHEMBL8123743 | 0.72 | KIF11 (0.53) | KIF11CA1CA2CA9CA12 | |
| SCHEMBL29068282 | 0.71 | KIF11 (0.59) | KIF11CA1CA2CA9MAPT | |
| SCHEMBL4225010 | 0.71 | KIF11 (0.53) | KIF11CA1CA2CA9CA12 | |
| SCHEMBL6114563 | 0.71 | PTGS2 (0.50) | KIF11CA1CA2CA9MMP1 | |
| SCHEMBL2006613 | 0.71 | KIF11 (0.50) | KIF11CA1CA2CA9CA12 | |
| SCHEMBL21595326 | 0.69 | PTGS2 (0.49) | KIF11CA1CA2CA9MMP1 | |
| SCHEMBL6921092 | 0.69 | IDO1 (0.55) | MMP1KMT2AMAOB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5573708-A | ACID-SUBSTITUTED PERFLUOROALKYLBENZENES | UNION CHEMICAL CO., LTD. (JP) | 1996-11-12 | — | — | US | claimed |
| EP-0569884-B1 | Rust inhibitor | UNION CHEMICAL CO LTD (JP) | 1996-09-18 | — | — | EP | claimed |
| US-5487846-A | FLUORINE-SUBSTITUTED BENZENE DERIVATIVES | UNION CHEMICAL CO., LTD. (JP) | 1996-01-30 | — | — | US | claimed |
| EP-0569884-A1 | Rust inhibitor | UNION CHEMICAL CO., LTD. (JP) | 1993-11-18 | — | — | EP | claimed |
| EP-0569884-B1 | Rust inhibitor | UNION CHEMICAL CO LTD (JP) | 1996-09-18 | — | — | EP | disclosed |
| US-5487846-A | FLUORINE-SUBSTITUTED BENZENE DERIVATIVES | UNION CHEMICAL CO., LTD. (JP) | 1996-01-30 | — | — | US | disclosed |
| EP-0569884-A1 | Rust inhibitor | UNION CHEMICAL CO., LTD. (JP) | 1993-11-18 | — | — | EP | disclosed |