Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL15211853 | 0.85 | MBOAT4 (0.43) | ESR1PPARDPPARAFFAR1ESR2 | |
| SCHEMBL15211694 | 0.85 | IKBKB (0.36) | ESR1CNR2PPARDPPARAESR2 | |
| SCHEMBL15211206 | 0.81 | PPARD (0.39) | ESR1PPARDPPARAFFAR1ESR2 | |
| SCHEMBL15211494 | 0.80 | FFAR1 (0.39) | ESR1PPARDPPARAFFAR1ALDH1A1 | |
| SCHEMBL15211431 | 0.79 | TP53 (0.35) | ESR1CNR2PPARDPPARAESR2 | |
| SCHEMBL15212672 | 0.75 | FFAR1 (0.45) | ESR1CNR2FFAR1ESR2ALDH1A1 | |
| SCHEMBL15211763 | 0.75 | PPARD (0.40) | ESR1PPARDPPARAFFAR1PPARG | |
| SCHEMBL15211501 | 0.73 | PPARD (0.45) | PPARDPPARAFFAR1ALDH1A1HPGD | |
| SCHEMBL15211492 | 0.73 | PPARD (0.55) | PPARDPPARAFFAR1PPARG | |
| SCHEMBL15211424 | 0.72 | ESR1 (0.45) | ESR1CNR2ESR2KDM4ETP53 |
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 |