Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 7/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 2/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7503100 | 0.94 | CYP2A6 (0.54) | FFAR1CYP2A6KCNH2TAAR1CYP1A2 | |
| SCHEMBL9328231 | 0.94 | CYP2A6 (0.54) | FFAR1CYP2A6KCNH2TAAR1CYP1A2 | |
| SCHEMBL9509240 | 0.91 | CYP2A6 (0.56) | FFAR1CYP2A6TAAR1ACACB | |
| SCHEMBL9512262 | 0.88 | FFAR1 (0.58) | FFAR1CYP2A6KCNH2TAAR1CYP1A2 | |
| SCHEMBL6546215 | 0.87 | TAAR1 (0.56) | CYP2A6KCNH2TAAR1CYP1A2CHKA | |
| SCHEMBL10510748 | 0.85 | HSD17B10 (0.45) | FFAR1KCNH2ACACB | |
| SCHEMBL10510758 | 0.85 | HSD17B10 (0.45) | FFAR1KCNH2ACACB | |
| SCHEMBL10512143 | 0.85 | HSD17B10 (0.45) | FFAR1KCNH2ACACB | |
| SCHEMBL10512200 | 0.85 | HSD17B10 (0.45) | FFAR1KCNH2ACACB | |
| SCHEMBL9349697 | 0.85 | FFAR1 (0.59) | FFAR1CYP2A6KCNH2TAAR1CYP1A2 |
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 |