Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 6/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 5/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL10501303 | 0.82 | ALDH1A1 (0.39) | ESR2CYP1A2HPGDHSD17B10ALDH1A1 | |
| SCHEMBL9396526 | 0.82 | CYP1A2 (0.44) | ESR2CYP1A2ESR1HSD17B10ALOX15 | |
| SCHEMBL10594294 | 0.79 | ESR2 (0.52) | ESR2CYP1A2ESR1ALOX5HPGD | |
| SCHEMBL3636461 | 0.75 | ESR1 (0.50) | ESR2CYP1A2ESR1CYP3A4CYP2D6 | |
| SCHEMBL8734007 | 0.75 | HSD17B1 (0.55) | ESR2CYP1A2ESR1CYP3A4CYP2D6 | |
| SCHEMBL21385240 | 0.71 | CYP1A2 (0.52) | ESR2CYP1A2ESR1ALOX5HSD17B10 | |
| SCHEMBL5030675 | 0.70 | CYP1A2 (0.44) | ESR2CYP1A2ESR1HSD17B10ALOX15 | |
| SCHEMBL8777379 | 0.70 | CYP1A2 (0.44) | ESR2CYP1A2ESR1HSD17B10ALOX15 | |
| SCHEMBL3016027 | 0.69 | ESR2 (1.00) | ESR2CYP1A2ESR1ALOX5HPGD | |
| SCHEMBL28461364 | 0.67 | HPGD (0.41) | ESR2ESR1ALOX5HPGDHSD17B10 |
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-0826680-A1 | Dihydronaphthalene and naphthalene compounds, intermediates, formulations, and methods | ELI LILLY AND COMPANY (US) | 1998-03-04 | — | — | EP | disclosed |