Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12414775 | 0.83 | CYP1A2 (0.41) | CYP1A2CYP2C19LMNARAB9AKDM4E | |
| SCHEMBL12294404 | 0.77 | — | — | |
| SCHEMBL16039441 | 0.72 | — | — | |
| SCHEMBL13066748 | 0.71 | — | — | |
| SCHEMBL859913 | 0.71 | — | — | |
| SCHEMBL859093 | 0.71 | — | — | |
| SCHEMBL2869007 | 0.71 | — | — | |
| SCHEMBL24777114 | 0.68 | KDM4E (0.35) | CYP1A2CYP2C19LMNARAB9AKDM4E | |
| SCHEMBL25946651 | 0.68 | LMNA (0.37) | CYP1A2CYP2C19LMNARAB9AKDM4E | |
| SCHEMBL31445255 | 0.67 | MAPT (0.37) | CYP1A2CYP2C19LMNARAB9AKDM4E |
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-2010149684-A1 | NEW COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS RELATING THERETO | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-12-29 | — | — | WO | disclosed |