Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | PRNP | P04156 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15211500 | 0.85 | ESR1 (0.39) | IKBKBCNR2ESR1ESR2F9 | |
| SCHEMBL15211308 | 0.80 | PPARD (0.37) | IKBKBS1PR1S1PR3ESR1ALDH1A1 | |
| SCHEMBL15211853 | 0.80 | MBOAT4 (0.43) | ESR1ESR2F9CA2PPARG | |
| SCHEMBL15211431 | 0.79 | TP53 (0.35) | CNR2ESR1ESR2F9ALDH1A1 | |
| SCHEMBL15211206 | 0.77 | PPARD (0.39) | ESR1ESR2F9CA2PPARG | |
| SCHEMBL15212672 | 0.77 | FFAR1 (0.45) | CNR2ESR1ESR2ALDH1A1HTT | |
| SCHEMBL15211763 | 0.75 | PPARD (0.40) | S1PR1ESR1PPARGPPARDPPARA | |
| SCHEMBL19190683 | 0.75 | PPARD (0.46) | IKBKBS1PR1S1PR3ALDH1A1PPARG | |
| SCHEMBL15211696 | 0.73 | PPARD (0.44) | ALDH1A1GLAHPGDPPARGHTT | |
| SCHEMBL15211307 | 0.73 | PPARD (0.55) | IKBKBALDH1A1PPARGPPARDPPARA |
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-2838891-A1 | AROMATIC RING COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2015-02-25 | — | — | EP | disclosed |
| WO-2013125732-A1 | AROMATIC RING COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-08-29 | — | — | WO | disclosed |