Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MELK | Q14680 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5633251 | 0.89 | ALDH1A1 (0.47) | ALDH1A1MELKMMP2MMP12FFAR1 | |
| SCHEMBL32144372 | 0.80 | FFAR1 (0.47) | ALDH1A1MELKFFAR1 | |
| SCHEMBL82303 | 0.80 | FFAR1 (0.47) | ALDH1A1MELKFFAR1 | |
| SCHEMBL1070719 | 0.78 | MAPT (0.35) | ALDH1A1FFAR1CYP3A4 | |
| SCHEMBL25201198 | 0.78 | HSD17B13 (0.47) | ALDH1A1MELKFFAR1KDM4ELMNA | |
| SCHEMBL30422943 | 0.78 | HSD17B13 (0.47) | ALDH1A1MELKFFAR1KDM4ELMNA | |
| SCHEMBL28886 | 0.78 | APP (0.35) | ALDH1A1CYP3A4 | |
| SCHEMBL1244860 | 0.76 | FFAR1 (0.51) | ALDH1A1MELKMMP2MMP12FFAR1 | |
| SCHEMBL79516 | 0.76 | ALDH1A1 (0.41) | ALDH1A1MELKMMP2MMP12MAPK14 | |
| SCHEMBL79281 | 0.76 | GRM5 (0.50) | ALDH1A1MELKFFAR1KDM4ELMNA |
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-1102739-B1 | GLUCOCORTICOID AND THYROID HORMONE RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS | KAROBIO AB (SE) | 2003-04-23 | — | — | EP | disclosed |
| US-6492424-B1 | Glucocorticoid and thyroid hormone receptor ligands for the treatment of metabolic disorders | KARO BIO AB (SE) | 2002-12-10 | — | — | US | disclosed |