Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PYGL | P06737 | 5/20 | 0.36 |
| ▸ | PYGM | P11217 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10649530 | 0.81 | PYGL (0.39) | POLBTSHRALDH1A1KDM4EBCHE | |
| SCHEMBL9865516 | 0.75 | PYGL (0.48) | POLBTSHRALDH1A1KDM4ECYP3A4 | |
| SCHEMBL10653759 | 0.74 | CYP3A4 (0.39) | POLBTSHRALDH1A1KDM4ECYP3A4 | |
| SCHEMBL10967987 | 0.73 | ALDH1A1 (0.44) | POLBTSHRALDH1A1KDM4ECYP3A4 | |
| SCHEMBL10648966 | 0.73 | ALDH1A1 (0.56) | POLBTSHRALDH1A1KDM4ECYP3A4 | |
| SCHEMBL11016561 | 0.73 | TSHR (0.41) | POLBTSHRALDH1A1KDM4EBCHE | |
| SCHEMBL10659301 | 0.72 | PYGL (0.52) | ALDH1A1PYGLPYGM | |
| SCHEMBL9865957 | 0.71 | PYGL (0.44) | POLBTSHRALDH1A1KDM4ECYP3A4 | |
| SCHEMBL9829022 | 0.71 | PYGL (0.48) | PYGLPYGM | |
| SCHEMBL9865258 | 0.70 | CYP3A4 (0.47) | POLBTSHRALDH1A1KDM4ECYP3A4 |
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-0173205-A2 | 1,4-Dihydropyridazine derivatives, process for their preparation and their use in medicaments | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |