Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 6/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 6/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9495020 | 0.91 | ACACB (0.51) | ACACBFFAR1MCHR1NPC1RAB9A | |
| SCHEMBL9496392 | 0.89 | ACACB (0.50) | ACACBFFAR1MCHR1NPC1RAB9A | |
| SCHEMBL9497920 | 0.88 | ACACB (0.43) | ACACBFFAR1MCHR1 | |
| SCHEMBL9495001 | 0.88 | ACACB (0.49) | ACACBFFAR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9494937 | 0.87 | ACACB (0.56) | ACACBFFAR1MCHR1NPC1RAB9A | |
| SCHEMBL9495793 | 0.85 | FFAR1 (0.42) | ACACBFFAR1MCHR1 | |
| SCHEMBL9495560 | 0.85 | ACACB (0.41) | ACACBFFAR1MCHR1 | |
| SCHEMBL10512766 | 0.83 | ACACB (0.41) | ACACBFFAR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9497945 | 0.83 | NFKB1 (0.42) | ACACBFFAR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9495456 | 0.83 | NFKB1 (0.42) | ACACBFFAR1NPC1RAB9ASMN1; SMN2 |
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 |