Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.59 |
| ▸ | ACACB | O00763 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | LPL | P06858 | 1/20 | 0.42 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL9349697 | 1.00 | FFAR1 (0.59) | FFAR1ACACBCYP1A2CYP2A6TAAR1 | |
| SCHEMBL9512262 | 0.98 | FFAR1 (0.58) | FFAR1ACACBCYP1A2CYP2A6TAAR1 | |
| SCHEMBL8141107 | 0.91 | ACACB (0.54) | FFAR1ACACBCA2LPLLIPG | |
| SCHEMBL9328434 | 0.91 | ACACB (0.54) | FFAR1ACACBCA2LPLLIPG | |
| SCHEMBL9511319 | 0.89 | ACACB (0.53) | FFAR1ACACBCA2LPLLIPG | |
| SCHEMBL9346602 | 0.88 | FFAR1 (0.56) | FFAR1CYP1A2CYP2A6TAAR1KCNH2 | |
| SCHEMBL9328412 | 0.88 | FFAR1 (0.56) | FFAR1CYP1A2CYP2A6TAAR1KCNH2 | |
| SCHEMBL6142457 | 0.87 | CYP2A6 (0.46) | FFAR1ACACBCYP1A2CYP2A6TAAR1 | |
| SCHEMBL5493944 | 0.86 | CYP1A2 (0.59) | CYP1A2CYP2A6TAAR1KCNH2CA2 | |
| SCHEMBL326914 | 0.86 | CYP1A2 (0.59) | CYP1A2CYP2A6TAAR1KCNH2CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0345013-B1 | 1-(4-alkylphenylethynyl)-4-(alkylphenylethynyl) benzenes | CHISSO CORP (JP) | 1994-03-16 | — | — | EP | disclosed |
| US-5250216-A | 1-(4-alkylphenylethynyl)-4-(alkylphenylethynyl)-benzene | CHISSO CORPORATION (JP) | 1993-10-05 | — | — | US | disclosed |
| EP-0345013-A2 | 1-(4-alkylphenylethynyl)-4-(alkylphenylethynyl) benzenes | Chisso Corporation (JP) | 1989-12-06 | — | — | EP | disclosed |