Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | PREP | P48147 | 4/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18068155 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL18018350 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL384513 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL2214614 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL23668781 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL24113163 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL19064732 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL905312 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL21530145 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 | |
| SCHEMBL2214621 | 1.00 | NR1H2 (0.42) | NR1H2HSD17B10CHRM2CHRM1CHRM3 |
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-2814822-B1 | NOVEL PYRROLIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2016-04-20 | — | — | EP | disclosed |
| WO-2013120921-A9 | NOVEL PYRROLIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2015-10-08 | — | — | WO | disclosed |
| WO-2013120921-A1 | NOVEL PYRROLIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2013-08-22 | — | — | WO | disclosed |