Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL20819697 | 0.89 | L3MBTL1 (0.39) | CYP1A2CYP2C9CYP2C19KDM4EALDH1A1 | |
| SCHEMBL20828647 | 0.78 | — | — | |
| SCHEMBL20828899 | 0.77 | — | — | |
| SCHEMBL20828643 | 0.77 | GAA (0.33) | ALDH1A1MAPT | |
| SCHEMBL29118533 | 0.75 | S1PR2 (0.32) | MAPTNPSR1L3MBTL1 | |
| SCHEMBL29118537 | 0.74 | S1PR1 (0.33) | L3MBTL1 | |
| SCHEMBL20828642 | 0.72 | — | — | |
| SCHEMBL13671822 | 0.72 | PDE3B (0.40) | ESR1CYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL17770800 | 0.72 | TLR8 (0.38) | ESR1CYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL13671568 | 0.71 | ESR1 (0.40) | ESR1CYP1A2CYP2C9CYP2C19KDM4E |
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-2019052973-A1 | DIBENZOFURAN AND DIBENZOTHIOPHENE DERIVATIVES | MERCK PATENT GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |