Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 12/20 | 0.61 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9496485 | 0.94 | ACACB (0.56) | ACACBMCHR1CHRM1HTR2AALDH1A1 | |
| SCHEMBL9496612 | 0.93 | ACACB (0.57) | ACACBMCHR1LMNAL3MBTL1MAPT | |
| SCHEMBL9500600 | 0.92 | ACACB (0.54) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL9496910 | 0.92 | ACACB (0.59) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL9495171 | 0.91 | ACACB (0.53) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL9495677 | 0.91 | ACACB (0.53) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL9499863 | 0.91 | ACACB (0.58) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL9499858 | 0.90 | ACACB (0.59) | ACACBMCHR1 | |
| SCHEMBL9500434 | 0.90 | ACACB (0.63) | ACACBMCHR1CHRM1HTR2A | |
| SCHEMBL9498384 | 0.90 | ACACB (0.57) | ACACBMCHR1LMNAL3MBTL1ALDH1A1 |
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-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 |