Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.46 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | RBP4 | P02753 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL8550050 | 0.89 | TDP1 (0.46) | NR1H2KCNK3KCNK9TAS2R14LMNA | |
| SCHEMBL8553845 | 0.89 | CYP1A2 (0.46) | NR1H2TSHRSLC6A3LMNAGAA | |
| SCHEMBL27484659 | 0.84 | NR1H2 (0.50) | NR1H2NR1H3KCNK3KCNK9TAS2R14 | |
| SCHEMBL7041350 | 0.82 | TSHR (0.55) | TSHRSLC6A3LMNAGAAMYC | |
| SCHEMBL1994212 | 0.81 | CA12 (0.55) | TSHRTAS2R14LMNAGAARBP4 | |
| SCHEMBL7212456 | 0.79 | TSHR (0.52) | TSHRKCNK3KCNK9SLC6A3LMNA | |
| SCHEMBL8550492 | 0.79 | CYP1A2 (0.44) | TSHRSLC6A3GAAPDK2CA12 | |
| SCHEMBL3717986 | 0.78 | GAA (0.56) | NR1H2NR1H3KCNK3KCNK9LMNA | |
| SCHEMBL31369140 | 0.78 | GAA (0.56) | NR1H2NR1H3KCNK3KCNK9LMNA | |
| SCHEMBL8547750 | 0.78 | MAPT (0.59) | TSHRSLC6A3LMNAGAAMYC |
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 |
|---|---|---|---|---|---|---|---|
| EP-0825187-A1 | Condensed pyridazinyl guanidines, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |