Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL810240 | 1.00 | CA1 (0.37) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5180906 | 1.00 | CA1 (0.37) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5180894 | 1.00 | CA1 (0.37) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5180231 | 1.00 | CA1 (0.37) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL2526371 | 0.96 | HCRTR2 (0.34) | CA1CA2CA12MMP2MMP9 | |
| Benzene SCHEMBL5180623 | 0.93 | MMP2 (0.33) | CA1CA2CA12MMP2MMP9 | |
| Benzene SCHEMBL5180762 | 0.93 | MMP2 (0.33) | CA1CA2CA12MMP2MMP9 | |
| Hexamethylbenzene SCHEMBL5415733 | 0.90 | HCRTR2 (0.33) | CA1CA2CA12MMP2MMP9 | |
| Hexamethylbenzene SCHEMBL5430986 | 0.90 | HCRTR2 (0.33) | CA1CA2CA12MMP2MMP9 | |
| SCHEMBL5423539 | 0.86 | SYK (0.38) | PTGS1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1439159-B1 | Process for producing optically active compound | KANTO KAGAKU (JP) | 2007-06-20 | — | — | EP | disclosed |
| WO-2005080299-A1 | NOVEL MONOSULFONYLATED AND CARBONYLATED CHIRAL COMPOUNDS DERIVED FROM A DIAMINE OR AN AMINOALCOHOL AND CARRYING A PYRROLIDINYL GROUP, THE PREPARATION THEREOF, AND THE APPLICATIONS OF THE SAME IN ASYMMETRICAL CATALYSIS | RHODIA CHIMIE (FR) | 2005-09-01 | — | — | WO | disclosed |
| EP-1439159-A1 | Process for producing optically active compound | Kanto Kagaku Kabushiki Kaisha (JP) | 2004-07-21 | — | — | EP | disclosed |