Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 9/20 | 0.55 |
| ▸ | PPARA | Q07869 | 9/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.55 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4744118 | 1.00 | PPARG (0.55) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4748381 | 0.98 | PPARG (0.56) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4746251 | 0.98 | PPARG (0.56) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4744641 | 0.98 | PPARG (0.56) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4744720 | 0.93 | PPARG (0.52) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4744723 | 0.93 | PPARG (0.52) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4744590 | 0.92 | ALDH1A1 (0.61) | PPARGPPARACYP2C9KCNH2CD274 | |
| SCHEMBL4747847 | 0.91 | CD274 (0.63) | PPARGPPARACD274KDRPOLB | |
| SCHEMBL4743927 | 0.91 | CD274 (0.65) | PPARGPPARACD274KDRPOLB | |
| SCHEMBL4744001 | 0.91 | CD274 (0.65) | PPARGPPARACD274KDRPOLB |
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 |