Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.60 |
| ▸ | CA2 | P00918 | 2/20 | 0.60 |
| ▸ | CA9 | Q16790 | 2/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | MMP2 | P08253 | 1/20 | 0.55 |
| ▸ | MMP7 | P09237 | 1/20 | 0.55 |
| ▸ | MMP14 | P50281 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | PARL | Q9H300 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP12 | P39900 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6681224 | 0.84 | HTR6 (0.58) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL9001233 | 0.79 | HTR6 (0.68) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL18194389 | 0.79 | HTR6 (0.68) | CA12CA2CA9CA1MMP2 | |
| (Phenylsulfonyl)Benzene SCHEMBL28196220 | 0.77 | HTR6 (0.74) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL3026340 | 0.77 | HTR6 (0.74) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL15849846 | 0.75 | TSHR (0.71) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL15708961 | 0.75 | CA12 (0.60) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL21993320 | 0.75 | ALDH1A1 (0.71) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL21993467 | 0.75 | TSHR (0.71) | CA12CA2CA9CA1MMP2 | |
| SCHEMBL308881 | 0.75 | CA2 (1.00) | CA12CA2CA9CA1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2316830-A2 | N-sulphonylated amino acid derivatives and their use as matriptase inhibitors | The Medicines Company (Leipzig) GmbH (DE) | 2011-05-04 | — | — | EP | disclosed |