Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.43 |
| ▸ | CA2 | P00918 | 5/20 | 0.43 |
| ▸ | CA9 | Q16790 | 5/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11617000 | 0.91 | LMNA (0.52) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL10920908 | 0.87 | LMNA (0.67) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL11620314 | 0.87 | LMNA (0.54) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL3777192 | 0.81 | LMNA (0.68) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL11613846 | 0.80 | GLA (0.56) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL1978635 | 0.80 | CYP2C19 (0.62) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL681530 | 0.79 | LMNA (0.73) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL11787672 | 0.78 | ALDH1A1 (0.48) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL7557801 | 0.77 | LMNA (0.45) | LMNAMAPK1ALDH1A1THRBTSHR | |
| SCHEMBL11732763 | 0.75 | LMNA (0.48) | LMNAMAPK1ALDH1A1THRBTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4080340-A | Nitroimidazoles | MERCK & CO., INC. (US) | 1978-03-21 | — | — | US | disclosed |
| US-4010176-A | Isoxazole substituted nitroimidazoles | MERCK & CO., INC. (US) | 1977-03-01 | — | — | US | disclosed |