Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | PKLR | P30613 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | ELOVL6 | Q9H5J4 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28801610 | 0.85 | CTSS (0.44) | CTSSPKMPKLRHTTCNR1 | |
| SCHEMBL12692920 | 0.81 | CTSS (0.52) | CTSSPKMPKLRHTTCNR1 | |
| SCHEMBL10476075 | 0.80 | CNR1 (0.45) | CTSSHTTCNR1ELOVL6GAA | |
| SCHEMBL28801608 | 0.79 | CTSS (0.44) | CTSSPKMPKLRHTTCNR1 | |
| SCHEMBL1498331 | 0.78 | PKM (0.40) | PKMPKLRHTTGAAHPGD | |
| SCHEMBL5915231 | 0.78 | DRD2 (0.53) | — | |
| SCHEMBL1761018 | 0.77 | CNR1 (0.50) | CTSSCNR1ELOVL6LMNAADORA2A | |
| SCHEMBL2423283 | 0.77 | CA1 (0.51) | CTSSPKMPKLRHTTCNR1 | |
| SCHEMBL1498303 | 0.76 | CNR1 (0.51) | CTSSHTTCNR1ELOVL6CA1 | |
| SCHEMBL1498586 | 0.74 | CNR1 (0.47) | CTSSCNR1ELOVL6GAALMNA |
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-2477963-A1 | ARYL SULPHONE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Zalicus Pharmaceuticals Ltd. (CA) | 2012-07-25 | — | — | EP | disclosed |