Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.63 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.63 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.63 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.63 |
| ▸ | DRD1 | P21728 | 1/20 | 0.63 |
| ▸ | HRH2 | P25021 | 1/20 | 0.63 |
| ▸ | HTR2A | P28223 | 1/20 | 0.63 |
| ▸ | HTR2C | P28335 | 1/20 | 0.63 |
| ▸ | HRH1 | P35367 | 1/20 | 0.63 |
| ▸ | DRD3 | P35462 | 1/20 | 0.63 |
| ▸ | SCN1A | P35498 | 1/20 | 0.63 |
| ▸ | THPO | P40225 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL20103745 | 0.98 | CYP3A4 (0.61) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL11858247 | 0.98 | CYP3A4 (0.66) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL23225659 | 0.98 | CYP3A4 (0.66) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL23225661 | 0.95 | CYP3A4 (0.61) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL23225660 | 0.93 | CYP3A4 (0.59) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL9013443 | 0.93 | CYP3A4 (0.55) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL18477543 | 0.91 | CYP3A4 (0.54) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL2925260 | 0.88 | CYP3A4 (0.51) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL3637470 | 0.86 | CYP3A4 (0.47) | CYP3A4LMNAABCB11CYP1A2CHRM2 | |
| SCHEMBL1311224 | 0.85 | CYP3A4 (0.52) | CYP3A4LMNAABCB11CYP1A2CHRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0990634-B1 | ACYLATING AGENTS, ACYLATION METHOD WITH THE USE OF THE SAME AND ADAMANTANE DERIVATIVES | DAICEL CHEM (JP) | 2013-04-10 | — | — | EP | disclosed |
| US-6429314-B1 | USING 1,2-DICARBONYL DERIVATIVE OR ITS HYDROXY REDUCTIVE, OXYGEN, COBALT ACETATE METAL COMPOUND, AND N-HYDROXYPHTHALIMIDE OR OTHER IMIDE DERIVATIVE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-08-06 | — | — | US | disclosed |
| EP-0990634-A1 | ACYLATING AGENTS, ACYLATION METHOD WITH THE USE OF THE SAME AND ADAMANTANE DERIVATIVES | Daicel Chemical Industries, Ltd. (JP) | 2000-04-05 | — | — | EP | disclosed |