Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | FDPS | P14324 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29163123 | 0.91 | FDPS (0.42) | CA2FDPSALDH1A1DNM1TSHR | |
| SCHEMBL11496837 | 0.81 | CA2 (0.42) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL17607693 | 0.81 | CA2 (0.35) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL12979777 | 0.81 | ALDH1A1 (0.43) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL1024157 | 0.81 | CA2 (0.35) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL20223464 | 0.79 | FDPS (0.37) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL598355 | 0.78 | TSHR (0.38) | TDP1TSHR | |
| SCHEMBL8862310 | 0.77 | FDPS (0.38) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL868015 | 0.77 | ALDH1A1 (0.42) | CA2MAPK1CA1FDPSALDH1A1 | |
| SCHEMBL23468408 | 0.76 | CA2 (0.39) | CA2MAPK1CA1FDPSALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012034626-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2012-03-22 | — | — | WO | disclosed |