Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR2 | O15552 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7711076 | 0.84 | POLB (0.58) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL1742115 | 0.84 | POLB (0.58) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL16075922 | 0.84 | POLB (0.58) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL27515059 | 0.82 | FFAR2 (0.48) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL23564521 | 0.82 | FFAR2 (0.48) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL1289928 | 0.81 | CYP2C9 (0.48) | FFAR2CYP2C9CYP2C19POLBBRD4 | |
| SCHEMBL9587806 | 0.80 | KCNQ2 (0.45) | KCNQ2HTTHDAC4HDAC7HDAC5 | |
| SCHEMBL4517176 | 0.79 | L3MBTL1 (0.49) | FFAR2CYP2C9CYP2C19POLBKMT2A | |
| SCHEMBL7629387 | 0.79 | L3MBTL1 (0.61) | FFAR2CYP2C9CYP2C19POLBKMT2A | |
| SCHEMBL27676916 | 0.79 | L3MBTL1 (0.61) | FFAR2CYP2C9CYP2C19POLBKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5190946-A | Piperazine compounds restore sensitivity to drug resistant cancer cells | HOFFMANN-LA ROCHE INC. (US) | 1993-03-02 | — | — | US | claimed |
| EP-0443569-A2 | Diamine derivatives and their use in oncology | F. HOFFMANN-LA ROCHE AG (CH) | 1991-08-28 | — | — | EP | claimed |
| US-5190946-A | Piperazine compounds restore sensitivity to drug resistant cancer cells | HOFFMANN-LA ROCHE INC. (US) | 1993-03-02 | — | — | US | disclosed |
| EP-0443569-A2 | Diamine derivatives and their use in oncology | F. HOFFMANN-LA ROCHE AG (CH) | 1991-08-28 | — | — | EP | disclosed |