Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 7/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5182563 | 1.00 | CA1 (0.40) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5181970 | 1.00 | CA1 (0.40) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5182557 | 1.00 | CA1 (0.40) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL809996 | 1.00 | CA1 (0.40) | CA1CA2CA12MMP2MMP9 | |
| Benzene SCHEMBL5179558 | 0.92 | ALDH1A1 (0.36) | CA1CA2CA12MMP2MMP9 | |
| Benzene SCHEMBL5179367 | 0.92 | ALDH1A1 (0.36) | CA1CA2CA12MMP2MMP9 | |
| Hexamethylbenzene SCHEMBL5418276 | 0.91 | LMNA (0.35) | CA1CA2CA12MMP2MMP9 | |
| Hexamethylbenzene SCHEMBL5418228 | 0.91 | LMNA (0.35) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5422332 | 0.86 | SYK (0.41) | ALDH1A1 | |
| P-Xylene SCHEMBL5424714 | 0.86 | ALDH1A1 (0.44) | HCRTR2ALDH1A1 |
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-1439159-B1 | Process for producing optically active compound | KANTO KAGAKU (JP) | 2007-06-20 | — | — | EP | disclosed |
| EP-1439159-A1 | Process for producing optically active compound | Kanto Kagaku Kabushiki Kaisha (JP) | 2004-07-21 | — | — | EP | disclosed |