Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 8/20 | 0.40 |
| ▸ | ESR1 | P03372 | 8/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14937782 | 0.79 | LDHA (0.41) | KIF11ALDH1A1 | |
| SCHEMBL14950659 | 0.77 | KIF11 (0.38) | KIF11ESR1ESR2ALDH1A1CYP3A4 | |
| SCHEMBL28229893 | 0.74 | HSD17B10 (0.46) | HSD17B10ESR1ESR2TTRCYP3A4 | |
| SCHEMBL67991 | 0.71 | HSD17B10 (0.56) | HSD17B10ESR1ESR2TTRALDH1A1 | |
| SCHEMBL30821022 | 0.70 | KIF11 (0.38) | HSD17B10KIF11ESR1ESR2ALDH1A1 | |
| SCHEMBL5307183 | 0.69 | KIF11 (0.50) | HSD17B10KIF11ESR1ESR2ALDH1A1 | |
| SCHEMBL14937828 | 0.68 | PPARG (0.37) | KIF11 | |
| SCHEMBL5878646 | 0.67 | HSD17B10 (0.52) | HSD17B10ESR1ESR2TTRCYP3A4 | |
| SCHEMBL19691959 | 0.66 | POLB (0.44) | HSD17B10KIF11ALDH1A1 | |
| SCHEMBL28736885 | 0.66 | TSHR (0.34) | KIF11ALDH1A1 |
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-2776392-B1 | PROCESS FOR THE PREPARATION OF 1-ACYL-4-PHENYLSULFONYLPROLINAMIDE DERIVATIVES AND NEW INTERMEDIATES | HOFFMANN LA ROCHE (CH) | 2016-05-18 | — | — | EP | disclosed |
| WO-2013068434-A1 | PROCESS FOR THE PREPARATION OF 1-ACYL-4-PHENYLSULFONYLPROLINAMIDE DERIVATIVES AND NEW INTERMEDIATES | F. HOFFMANN-LA ROCHE AG (CH) | 2013-05-16 | — | — | WO | disclosed |