Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 4/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 4/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.31 |
| ▸ | NMT1 | P30419 | 1/20 | 0.30 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9500392 | 1.00 | FFAR1 (0.47) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9500412 | 1.00 | FFAR1 (0.47) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9500187 | 0.96 | FFAR1 (0.46) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9500167 | 0.96 | FFAR1 (0.46) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9500179 | 0.96 | FFAR1 (0.46) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9495489 | 0.95 | FFAR1 (0.45) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL10511869 | 0.95 | FFAR1 (0.45) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9498614 | 0.95 | FFAR1 (0.45) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL9495497 | 0.95 | FFAR1 (0.45) | FFAR1FFAR4MAOAMAOBACACB | |
| SCHEMBL10511864 | 0.95 | FFAR1 (0.45) | FFAR1FFAR4MAOAMAOBACACB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0306505-B1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1993-03-24 | — | — | EP | disclosed |
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |
| EP-0306505-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES. | MERCK PATENT GMBH (DE) | 1989-03-15 | — | — | EP | disclosed |
| WO-1988007523-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1988-10-06 | — | — | WO | disclosed |