Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 9/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 9/20 | 0.35 |
| ▸ | HPGDS | O60760 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | USP7 | Q93009 | 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 | |
|---|---|---|---|---|
| SCHEMBL5274698 | 0.77 | HSD17B1 (0.47) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL528811 | 0.65 | ABCB1 (0.48) | HSD17B1HSD17B2CYP3A4CYP2C9SREBF2 | |
| SCHEMBL28517648 | 0.65 | HSD17B1 (0.46) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL25146909 | 0.65 | ESR2 (0.49) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL18687702 | 0.64 | HSD17B1 (0.52) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL8006987 | 0.64 | TDP2 (0.48) | ESR1ESR2USP7 | |
| Propane SCHEMBL5843489 | 0.62 | HSD17B1 (0.71) | ESR1ESR2HSD17B1HSD17B2CYP3A4 | |
| SCHEMBL8713913 | 0.62 | MAPK1 (0.43) | HSD17B1HSD17B2CYP3A4CYP2C9CNR1 | |
| SCHEMBL4379660 | 0.62 | ALDH1A1 (0.44) | ESR1ESR2CYP3A4 | |
| SCHEMBL27559833 | 0.62 | HSD17B1 (0.63) | ESR1ESR2HSD17B1HSD17B2CYP3A4 |
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-1814847-A1 | NOVEL METHOD FOR PREPARING 3-[5'-(3,4-BIS-HYDROXYMETHYL-BENZYLOXY)-2'- ETHYL-2-PROPYL-BIPHENYL-4-YL]-PENTA-3-OL | Galderma Research & Development (FR) | 2007-08-08 | — | — | EP | disclosed |
| WO-2006053985-A1 | NOVEL METHOD FOR PREPARING 3-[5'-(3,4-BIS-HYDROXYMETHYL-BENZYLOXY)-2'- ETHYL-2-PROPYL-BIPHENYL-4-YL]-PENTA-3-OL | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2006-05-26 | — | — | WO | disclosed |