Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.51 |
| ▸ | PPARG | P37231 | 10/20 | 0.48 |
| ▸ | PPARA | Q07869 | 9/20 | 0.48 |
| ▸ | PPARD | Q03181 | 3/20 | 0.47 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.45 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4744563 | 1.00 | KDM4E (0.52) | KDM4EALDH1A1CD274PPARGPPARA | |
| SCHEMBL4748235 | 0.98 | ALDH1A1 (0.49) | KDM4EALDH1A1CD274PPARGPPARA | |
| SCHEMBL4748026 | 0.98 | ALDH1A1 (0.49) | KDM4EALDH1A1CD274PPARGPPARA | |
| SCHEMBL4746574 | 0.98 | ALDH1A1 (0.49) | KDM4EALDH1A1CD274PPARGPPARA | |
| SCHEMBL4744592 | 0.93 | PPARG (0.55) | KDM4EALDH1A1PPARGPPARACYP2C9 | |
| SCHEMBL4744029 | 0.93 | PPARG (0.55) | KDM4EALDH1A1PPARGPPARACYP2C9 | |
| SCHEMBL4743830 | 0.91 | PPARG (0.56) | CD274PPARGPPARAPDCD1FFAR1 | |
| SCHEMBL4744050 | 0.91 | PPARG (0.56) | CD274PPARGPPARAPDCD1FFAR1 | |
| SCHEMBL4743829 | 0.91 | PPARG (0.56) | CD274PPARGPPARAPDCD1FFAR1 | |
| SCHEMBL4744118 | 0.91 | PPARG (0.55) | ALDH1A1CD274PPARGPPARAPDCD1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008117982-A1 | HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME | CRYSTAL GENOMICS, INC. (KR) | 2008-10-02 | — | — | WO | claimed |
| WO-2008117982-A1 | HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME | CRYSTAL GENOMICS, INC. (KR) | 2008-10-02 | — | — | WO | disclosed |