Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | GAA | P10253 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | OXTR | P30559 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11120207 | 0.90 | CYP2C19 (0.58) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL11118092 | 0.87 | CYP2C19 (0.55) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL11121167 | 0.85 | CYP2C19 (0.57) | CYP2C19KMT2AGAAMEN1ALDH1A1 | |
| SCHEMBL11117181 | 0.81 | CYP2C19 (0.67) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL11118953 | 0.80 | ADRA1D (0.53) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL11128806 | 0.77 | CYP2C19 (0.62) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL11127656 | 0.77 | CYP2C19 (0.62) | CYP2C19KMT2AGAAMEN1OXTR | |
| SCHEMBL2699791 | 0.76 | KMT2A (0.76) | CYP2C19KMT2AMEN1CYP2D6PKM | |
| SCHEMBL11114004 | 0.76 | ALDH1A1 (0.52) | CYP2C19KMT2AGAAMEN1ALDH1A1 | |
| SCHEMBL3443849 | 0.76 | L3MBTL1 (0.51) | KMT2AMEN1ALDH1A1LMNAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0034415-B1 | 1-(CYCLOHEXYL OR CYCLOHEXENYL)-4-ARYL-4-PIPERIDINECARBOXYLIC ACID DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1984-05-30 | — | — | EP | disclosed |
| US-4369184-A | ANTIHISTAMINES; HETEROCYCLIC NITRILES | JANSSEN PHARMACEUTICA N.V. (BE) | 1983-01-18 | — | — | US | disclosed |