Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12542357 | 0.87 | CA1 (0.41) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12693028 | 0.87 | EPHX2 (0.47) | NPSR1GAALMNASMN1; SMN2EPHX2 | |
| SCHEMBL12693070 | 0.87 | GAA (0.42) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12542359 | 0.87 | CA1 (0.41) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12544650 | 0.87 | GAA (0.42) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12693027 | 0.87 | CA1 (0.41) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12542423 | 0.87 | EPHX2 (0.47) | NPSR1GAALMNASMN1; SMN2EPHX2 | |
| SCHEMBL12542424 | 0.87 | EPHX2 (0.47) | NPSR1GAALMNASMN1; SMN2EPHX2 | |
| SCHEMBL12692924 | 0.87 | CA1 (0.47) | NPSR1CA1CA2MMP1MMP2 | |
| SCHEMBL12692970 | 0.86 | RORC (0.46) | NPSR1CA1CA2MMP1MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102762534-A | Aryl sulfone derivatives as calcium channel blockers | ZALICUS PHARMACEUTICALS LTD | 2012-10-31 | — | — | CN | disclosed |