Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | TPH1 | P17752 | 1/20 | 0.40 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | USP1 | O94782 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL9707246 | 0.90 | MEN1 (0.46) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9708112 | 0.89 | KMT2A (0.42) | MEN1KMT2ACYP2C9CYP2C19PPARG | |
| SCHEMBL9707560 | 0.89 | PPARG (0.42) | KMT2APPARGAGTR1AGTR2USP1 | |
| SCHEMBL9707643 | 0.89 | MEN1 (0.48) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9707717 | 0.88 | ALDH1A1 (0.49) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9708525 | 0.88 | TPH2 (0.47) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9707557 | 0.88 | ALDH1A1 (0.43) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9707556 | 0.88 | AGTR1 (0.40) | MEN1KMT2AALDH1A1HPGDGAA | |
| SCHEMBL9707464 | 0.87 | MEN1 (0.45) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL9708371 | 0.87 | KMT2A (0.44) | MEN1KMT2ACYP2C9CYP2C19PPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992007852-A1 | BIPHENYLALKYL XANTHINE COMPOUNDS FOR TREATMENT OF CARDIOVASCULAR DISORDERS | G.D. SEARLE & CO. (US) | 1992-05-14 | — | — | WO | disclosed |