Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6088577 | 0.83 | FYN (0.47) | ALDH1A1TSHRCYP2D6CTNNB1KDM4E | |
| SCHEMBL6087766 | 0.82 | CHRNB2 (0.53) | MAPK1CYP1A2CYP2D6CYP2C19CTNNB1 | |
| SCHEMBL16668774 | 0.81 | TSHR (0.55) | ALDH1A1RECQLTSHRMAPK1CYP1A2 | |
| SCHEMBL48418 | 0.80 | ALDH1A1 (0.70) | ALDH1A1RECQLTSHRMAPK1CYP2D6 | |
| SCHEMBL13645864 | 0.80 | DRD2 (0.50) | TSHRMAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL22297588 | 0.80 | KDM4E (0.52) | ALDH1A1RECQLTSHRMAPK1CYP1A2 | |
| SCHEMBL3267175 | 0.79 | TSHR (0.62) | ALDH1A1RECQLTSHRMAPK1CYP1A2 | |
| SCHEMBL5864547 | 0.79 | TSHR (0.58) | ALDH1A1RECQLTSHRMAPK1KDM4E | |
| SCHEMBL6089644 | 0.79 | APP (0.41) | ALDH1A1TSHRMAPK1CYP1A2CYP2D6 | |
| SCHEMBL9369921 | 0.79 | KCNA3 (0.50) | ALDH1A1RECQLCYP1A2CYP2C19MAPT |
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-1177176-A1 | TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS | Aventis Pharma Deutschland GmbH (DE) | 2002-02-06 | — | — | EP | disclosed |
| WO-2000064876-A1 | TRI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-11-02 | — | — | WO | disclosed |