Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MMP10 | P09238 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 2/20 | 0.35 |
| ▸ | MMP13 | P45452 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4780684 | 0.82 | LPAR1 (0.45) | ESR1CYP19A1ESR2CALM1MAPT | |
| SCHEMBL4779389 | 0.77 | PPARG (0.37) | PPARGPPARA | |
| SCHEMBL4908590 | 0.77 | PPARG (0.37) | PPARGPPARA | |
| SCHEMBL13721910 | 0.72 | PPARA (0.47) | CALM1MAPTLMNAPPARGPPARA | |
| SCHEMBL13721783 | 0.72 | PPARA (0.51) | CALM1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL4778824 | 0.69 | LPAR1 (0.42) | ESR1ESR2MAPTPPARGPPARA | |
| SCHEMBL14281860 | 0.68 | PPARG (0.36) | RAB9ANPC1NPSR1LMNAPPARG | |
| SCHEMBL19541466 | 0.68 | RAB9A (0.60) | RAB9ANPSR1LMNA | |
| SCHEMBL14306604 | 0.67 | BCHE (0.39) | NPSR1LMNAPPARGPPARAL3MBTL1 | |
| SCHEMBL17355743 | 0.66 | RAB9A (0.42) | SMN1; SMN2RAB9ANPC1MAPTKCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008006044-A2 | SUBSTITUTED ACID DERIVATIVES USEFUL AS ANTIDIABETIC AND ANTIOBESITY AGENTS AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-01-10 | — | — | WO | disclosed |