Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | JAK2 | O60674 | 4/20 | 0.42 |
| ▸ | JAK1 | P23458 | 4/20 | 0.42 |
| ▸ | JAK3 | P52333 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL10266067 | 0.86 | ALDH1A1 (0.56) | ALDH1A1TSHRJAK2JAK1JAK3 | |
| SCHEMBL5537204 | 0.83 | EPHX2 (0.47) | ALDH1A1LMNA | |
| SCHEMBL24619128 | 0.80 | CA1 (0.57) | ALDH1A1TSHRJAK2JAK1JAK3 | |
| SCHEMBL5539426 | 0.76 | CA1 (0.50) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL18914213 | 0.76 | PDK1 (0.49) | ALDH1A1SIGMAR1KDM4E | |
| SCHEMBL27905550 | 0.76 | ALDH1A1 (0.57) | ALDH1A1TSHRJAK2JAK1JAK3 | |
| SCHEMBL13741699 | 0.75 | TSHR (0.54) | ALDH1A1TSHRJAK2JAK1JAK3 | |
| SCHEMBL16418437 | 0.75 | ALDH1A1 (0.51) | ALDH1A1TSHRJAK2JAK1JAK3 | |
| SCHEMBL18909863 | 0.74 | PDK1 (0.56) | ALDH1A1SIGMAR1KDM4E | |
| SCHEMBL18907740 | 0.72 | PKM (0.48) | ALDH1A1SIGMAR1 |
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-8367666-B2 | 3-carbamoyl-2-pyridone derivatives | SHIONOGI & CO., LTD. (JP) | 2013-02-05 | — | — | US | disclosed |