Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 6/20 | 0.48 |
| ▸ | ACACB | O00763 | 5/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9495872 | 0.88 | MCHR1 (0.52) | MCHR1ACACBCHRM1HTR2ACYP2D6 | |
| SCHEMBL9855660 | 0.86 | EGLN1 (0.48) | MCHR1ACACBFFAR1FFAR4GRM5 | |
| SCHEMBL9494958 | 0.86 | ACACB (0.49) | MCHR1ACACBFFAR1FFAR4GRM5 | |
| SCHEMBL9498326 | 0.85 | MCHR1 (0.55) | MCHR1ACACBCHRM1HTR2ACYP2D6 | |
| SCHEMBL9497141 | 0.84 | MCHR1 (0.54) | MCHR1ACACBCHRM1HTR2ACYP2D6 | |
| SCHEMBL10520092 | 0.83 | MCHR1 (0.46) | MCHR1ACACBCHRM1CYP2D6FFAR1 | |
| SCHEMBL9500256 | 0.83 | MCHR1 (0.53) | MCHR1ACACBCHRM1HTR2AFFAR1 | |
| SCHEMBL9495546 | 0.83 | ACACB (0.53) | MCHR1ACACBCHRM1HTR2ACYP2D6 | |
| SCHEMBL9855141 | 0.82 | FFAR1 (0.42) | MCHR1ACACBFFAR1FFAR4CYP2A6 | |
| SCHEMBL9495802 | 0.82 | ACACB (0.46) | MCHR1ACACBFFAR1FFAR4GRM5 |
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 |