Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | PPME1 | Q9Y570 | 5/20 | 0.47 |
| ▸ | APEH | P13798 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11580970 | 0.82 | PPME1 (0.48) | PPME1APEHMAPTKMT2AMEN1 | |
| SCHEMBL11563828 | 0.81 | PPME1 (0.47) | PPME1APEHMAPTKMT2AMEN1 | |
| SCHEMBL11564974 | 0.79 | MAPT (0.54) | PPME1APEHMAPTTP53KMT2A | |
| SCHEMBL11567151 | 0.78 | KDM4E (0.58) | CA1CA2CA12CA9PPME1 | |
| SCHEMBL4173088 | 0.78 | TRPA1 (0.50) | TRPA1CA1CA2CA12CA9 | |
| SCHEMBL4173091 | 0.78 | TRPA1 (0.50) | TRPA1CA1CA2CA12CA9 | |
| SCHEMBL4173087 | 0.78 | TRPA1 (0.50) | TRPA1CA1CA2CA12CA9 | |
| SCHEMBL11557463 | 0.77 | LMNA (0.52) | PPME1APEHKMT2AMEN1KDM4E | |
| SCHEMBL11558137 | 0.77 | HPGD (0.60) | TRPA1CA1CA2CA12CA9 | |
| SCHEMBL11560496 | 0.76 | PPME1 (0.55) | PPME1APEHMAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4162321-A | Sulphur-containing amino-dihydropyridines, and their use as medicants | BAYER AKTIENGESELLSCHAFT (DE) | 1979-07-24 | — | — | US | disclosed |