Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | TACR2 | P21452 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9854946 | 0.98 | HSD17B10 (0.46) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9496289 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9496100 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9497071 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9497929 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9498005 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9499653 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9497511 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9497178 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9495008 | 0.94 | ACACB (0.49) | HSD17B10TSHRALDH1A1SMN1; SMN2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |
| EP-0306505-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES. | MERCK PATENT GMBH (DE) | 1989-03-15 | — | — | EP | disclosed |
| WO-1988007523-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1988-10-06 | — | — | WO | disclosed |