Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | DRD1 | P21728 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL9536108 | 0.77 | CYP2C19 (0.58) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL3345554 | 0.77 | CYP2C19 (0.58) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL6158201 | 0.75 | CYP2C19 (0.54) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL16910204 | 0.75 | CYP2C19 (0.47) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL17316190 | 0.75 | CYP2C19 (0.47) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL7638598 | 0.75 | CYP2C19 (0.47) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL8852722 | 0.70 | LMNA (0.32) | LMNATSHRHSD17B10 | |
| SCHEMBL2448330 | 0.69 | CYP1A2 (0.42) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL20471514 | 0.67 | CYP1A2 (0.37) | CYP2C19CYP1A2LMNATSHRALDH1A1 | |
| SCHEMBL7588707 | 0.66 | CYP1A2 (0.39) | CYP2C19CYP1A2LMNATSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8283200-A | — | — | None | — | — | JP | disclosed |
| JP-H08283200-A | NEW ESTER COMPOUND AND TRACTION DRIVE FLUID | MITSUBISHI GAS CHEM CO INC | 1996-10-29 | — | — | JP | disclosed |