Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 11/20 | 0.52 |
| ▸ | HSD17B2 | P37059 | 11/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.52 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.52 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6088276 | 0.80 | SMN1; SMN2 (0.49) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6668074 | 0.80 | MAOB (0.54) | MAPK1NOD2 | |
| SCHEMBL225146 | 0.79 | ESR1 (0.53) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6086911 | 0.77 | ESR2 (0.54) | CYP3A4CYP2C9CYP2C19CYP2D6BACE1 | |
| SCHEMBL6671006 | 0.77 | MTNR1A (0.39) | BACE1CYP11B1CYP11B2 | |
| SCHEMBL6050101 | 0.76 | CYP1A2 (0.49) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1026075 | 0.75 | HSD17B1 (0.68) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL14274032 | 0.73 | ALOX5 (0.47) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL14274050 | 0.73 | ALOX5 (0.40) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7705320 | 0.73 | ESR2 (0.53) | CYP3A4CYP2C9CYP2C19CYP2D6NPC1 |
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-0838459-B1 | Naphthyl compounds, compositions, and methods | LILLY CO ELI (US) | 2004-09-22 | — | — | EP | disclosed |
| US-5952350-A | INHIBITING BONE LOSS OR BONE RESORPTION, PARTICULARLY OSTEOPOROSIS, AND CARDIOVASCULAR DISORDERS INCLUDING HYPERLIPIDEMIA, AND ESTROGEN DEPENDENT CANCER | ELI LILLY AND COMPANY (US) | 1999-09-14 | — | — | US | disclosed |
| EP-0838459-A1 | Naphthyl compounds, compositions, and methods | ELI LILLY AND COMPANY (US) | 1998-04-29 | — | — | EP | disclosed |