Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 11/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL9496258 | 0.97 | ACACB (0.55) | ACACBMCHR1ALDH1A1LMNAHPGD | |
| SCHEMBL9496622 | 0.96 | ACACB (0.54) | ACACBMCHR1ALDH1A1HPGD | |
| SCHEMBL9495448 | 0.96 | ACACB (0.54) | ACACBMCHR1ALDH1A1HPGD | |
| SCHEMBL9496938 | 0.96 | ACACB (0.54) | ACACBMCHR1ALDH1A1HPGD | |
| SCHEMBL9500434 | 0.94 | ACACB (0.63) | ACACBMCHR1CHRM1HTR2A | |
| SCHEMBL9497336 | 0.93 | ACACB (0.52) | ACACBMCHR1CHRM1HTR2ACYP2D6 | |
| SCHEMBL9496485 | 0.90 | ACACB (0.56) | ACACBMCHR1ALDH1A1CHRM1HTR2A | |
| SCHEMBL9498322 | 0.90 | ACACB (0.50) | ACACBMCHR1ALDH1A1HPGD | |
| SCHEMBL9495543 | 0.90 | ACACB (0.56) | ACACBMCHR1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL9495806 | 0.89 | ACACB (0.55) | ACACBMCHR1ALDH1A1LMNAMAPT |
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 |