Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.46 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | MGMT | P16455 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PNP | P00491 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9351658 | 0.77 | CYP1A2 (0.51) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL31527929 | 0.73 | CYP1A2 (0.51) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL639898 | 0.73 | DPP4 (0.56) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL258583 | 0.73 | PDPK1 (0.59) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL29728815 | 0.73 | PDPK1 (0.59) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL30834788 | 0.72 | CYP1A2 (0.50) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL31012324 | 0.71 | CYP2C19 (0.63) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL546891 | 0.71 | CYP1A2 (0.49) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL17372399 | 0.71 | CYP2C19 (0.63) | CYP1A2CYP2C19CYP3A4CYP2D6HSP90AB1 | |
| SCHEMBL28960557 | 0.70 | CYP1A2 (0.51) | CYP1A2CYP2C19CYP3A4CYP2D6MEN1 |
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-1990006312-A1 | 2',3'-DIDEOXYRIBOFURANOSIDES AND PROCESS FOR PRODUCING THEM | INSTITUT FÜR MOLEKULARBIOLOGIE UND ANALYTIK (IMA) GMBH (DE) | 1990-06-14 | — | — | WO | disclosed |