Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | TPH1 | P17752 | 1/20 | 0.48 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.46 |
| ▸ | NOD2 | Q9HC29 | 2/20 | 0.46 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9708629 | 0.93 | AGTR1 (0.48) | MEN1KMT2ATPH1TPH2RAB9A | |
| SCHEMBL9707992 | 0.91 | USP2 (0.51) | MEN1KMT2ARAB9AUSP2AGTR1 | |
| SCHEMBL9708861 | 0.91 | TPH1 (0.51) | MEN1KMT2ATPH1TPH2RAB9A | |
| SCHEMBL9708297 | 0.91 | MEN1 (0.54) | MEN1KMT2ATPH1TPH2AGTR1 | |
| SCHEMBL9707996 | 0.91 | USP2 (0.52) | MEN1KMT2ATPH1TPH2RAB9A | |
| SCHEMBL9708307 | 0.91 | MEN1 (0.47) | MEN1KMT2ATPH1TPH2RAB9A | |
| SCHEMBL9708384 | 0.90 | MEN1 (0.48) | MEN1KMT2ATPH1TPH2USP2 | |
| SCHEMBL9708366 | 0.89 | BRAF (0.48) | MEN1KMT2ARAB9APOLBBRAF | |
| SCHEMBL9708587 | 0.89 | AGTR1 (0.45) | MEN1KMT2ATPH1TPH2AGTR1 | |
| SCHEMBL9707846 | 0.88 | ALDH1A1 (0.49) | MEN1KMT2ATPH1TPH2AGTR1 |
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 |