Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.45 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.45 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.40 |
| ▸ | FNTB | P49356 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6561397 | 0.82 | ACHE (0.61) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL18797759 | 0.80 | ACHE (0.65) | PGRHSD17B1HSD17B2ENPP3ACHE | |
| SCHEMBL2405824 | 0.79 | CYP3A4 (0.44) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL13547631 | 0.78 | ALDH1A1 (0.46) | ACHEAKR1C2AKR1C1MAPTNPC1 | |
| SCHEMBL29057032 | 0.78 | ACHE (0.55) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL23003863 | 0.78 | ACHE (0.55) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL29929976 | 0.78 | ACHE (0.55) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL5545442 | 0.78 | ACHE (0.55) | PGRHSD17B1HSD17B2ENPP3FYN | |
| SCHEMBL20689786 | 0.78 | TSHR (0.55) | PGRHSD17B1HSD17B2ENPP3ACHE | |
| SCHEMBL30493472 | 0.78 | ACHE (0.55) | PGRHSD17B1HSD17B2ENPP3FYN |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2177518-A1 | Organic compounds | Novartis AG (CH) | 2010-04-21 | — | — | EP | disclosed |