Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | SHBG | P04278 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | ESRRG | P62508 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 1/20 | 0.48 |
| ▸ | AR | P10275 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ME2 | P23368 | 1/20 | 0.48 |
| ▸ | ME1 | P48163 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10914051 | 0.85 | CYP2C19 (0.50) | ESR1ESR2CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL4235812 | 0.83 | ESR1 (0.67) | ESR1ESR2CYP3A4ALDH1A1SHBG | |
| SCHEMBL9787613 | 0.83 | SHBG (0.55) | ESR1ESR2CYP3A4ALDH1A1SHBG | |
| SCHEMBL11510565 | 0.83 | ESR2 (0.56) | ESR1ESR2CYP3A4ALDH1A1SHBG | |
| SCHEMBL3485439 | 0.83 | CYP2C19 (0.48) | ALDH1A1CYP2C19HIF1ALMNATSHR | |
| SCHEMBL57411 | 0.83 | CYP2C19 (0.69) | ESR1ESR2CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL13654250 | 0.82 | HIF1A (0.47) | ESR1ESR2CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL7566897 | 0.82 | CYP2C19 (0.47) | CYP2C19HIF1AHPGDME2ME1 | |
| SCHEMBL22458451 | 0.82 | CYP2C19 (0.47) | ALDH1A1CYP2C19HIF1ALMNA | |
| SCHEMBL16056956 | 0.82 | CYP2C19 (0.47) | ESR1ESR2CYP3A4ALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-20060257987-A1 | Ppar modulators | ELI LILLY AND COMPANY | 2006-11-16 | — | — | US | disclosed |
| EP-1660428-A1 | PPAR MODULATORS | ELI LILLY AND COMPANY (US) | 2006-05-31 | — | — | EP | disclosed |
| WO-2005019151-A1 | PPAR MODULATORS | ELI LILLY AND COMPANY (US) | 2005-03-03 | — | — | WO | disclosed |