Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.46 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.46 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14844290 | 0.98 | CYP1A2 (0.58) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL14676050 | 0.98 | CYP1A2 (0.58) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL28813204 | 0.95 | CYP1A2 (0.61) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL10891708 | 0.91 | CYP1A2 (0.64) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL30291130 | 0.88 | CYP1A2 (0.65) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL679338 | 0.88 | CYP1A2 (0.65) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL10890268 | 0.88 | CYP1A2 (0.64) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL30938689 | 0.87 | TSHR (0.47) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL9687968 | 0.85 | CYP1A2 (0.57) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 | |
| SCHEMBL27961047 | 0.84 | CYP1A2 (0.68) | CYP1A2ALDH1A1TDP1MAPK1SMN1; SMN2 |
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-0511879-A1 | Pyrazine derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1992-11-04 | — | — | EP | disclosed |