Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL7025199 | 1.00 | MEN1 (0.31) | MEN1KMT2APTGS2CYP3A4CYP2C8 | |
| SCHEMBL8390649 | 0.96 | CYP1A2 (0.33) | PTGS2CYP3A4 | |
| SCHEMBL7023040 | 0.96 | CYP1A2 (0.33) | PTGS2CYP3A4 | |
| SCHEMBL7024655 | 0.91 | TLR4 (0.32) | — | |
| SCHEMBL8385887 | 0.91 | TLR4 (0.32) | — | |
| SCHEMBL8389587 | 0.89 | — | — | |
| SCHEMBL8389583 | 0.89 | — | — | |
| SCHEMBL7030991 | 0.88 | — | — | |
| SCHEMBL8386994 | 0.88 | — | — | |
| SCHEMBL8388228 | 0.85 | MEN1 (0.33) | MEN1KMT2ACYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5888423-A | Fluorobenzyl ether derivatives | ROLIC AG (CH) | 1999-03-30 | — | — | US | disclosed |