Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 5/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | RARB | P10826 | 1/20 | 0.34 |
| ▸ | RARG | P13631 | 1/20 | 0.34 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL9510152 | 0.97 | FFAR1 (0.40) | FFAR1AAK1ACACBCYP2A6RARA | |
| SCHEMBL9511390 | 0.89 | FFAR1 (0.42) | FFAR1AAK1CYP17A1MCHR1ACACB | |
| SCHEMBL9509292 | 0.89 | RXRA (0.35) | MCHR1ACACBCYP2A6FAAH | |
| SCHEMBL9510224 | 0.87 | TSHR (0.43) | FFAR1AAK1ACACBRARARARB | |
| SCHEMBL7857744 | 0.86 | FFAR1 (0.44) | FFAR1AAK1ACACBCNR2 | |
| SCHEMBL9508905 | 0.86 | FFAR1 (0.44) | FFAR1AAK1ACACBCNR2 | |
| SCHEMBL9510127 | 0.85 | TSHR (0.48) | FFAR1RARARARBRARGPPARA | |
| SCHEMBL9508737 | 0.85 | CYP2A6 (0.37) | FFAR1ACACBCYP2A6 | |
| SCHEMBL9509358 | 0.85 | ACACB (0.37) | MCHR1ACACBCYP2A6 | |
| SCHEMBL9510181 | 0.84 | HSD17B10 (0.50) | FFAR1RARARARBRARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | disclosed |