Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 6/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9499801 | 0.99 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9494832 | 0.99 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9496920 | 0.99 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9500597 | 0.97 | ACACB (0.54) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9495882 | 0.97 | ACACB (0.56) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9494955 | 0.96 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9500184 | 0.96 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9500544 | 0.96 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9498834 | 0.96 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 | |
| SCHEMBL9495396 | 0.96 | ACACB (0.53) | ACACBL3MBTL1MAPTRAB9AMCHR1 |
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 |