Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | GRM5 | P41594 | 4/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | SCN10A | Q9Y5Y9 | 3/20 | 0.37 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9713632 | 0.87 | MCHR1 (0.36) | RXRAGRIN1GRIN2BACACBMCHR1 | |
| SCHEMBL9713096 | 0.85 | ACACB (0.45) | RXRAGRIN1GRIN2BACACBMCHR1 | |
| SCHEMBL9713434 | 0.82 | GRM5 (0.40) | RXRAGRIN1GRIN2BACACBMCHR1 | |
| SCHEMBL9712996 | 0.81 | ACACB (0.43) | RXRAGRIN1GRIN2BACACBMCHR1 | |
| SCHEMBL17225200 | 0.81 | ACACB (0.48) | ACACBMCHR1KCNH2GRM5MAOB | |
| SCHEMBL9713053 | 0.79 | ACACB (0.41) | RXRAGRIN1GRIN2BACACBMCHR1 | |
| SCHEMBL8620678 | 0.79 | ACACB (0.39) | ACACBMCHR1KCNH2GRM5ADRB3 | |
| SCHEMBL8620670 | 0.79 | ACACB (0.39) | ACACBMCHR1KCNH2GRM5ADRB3 | |
| SCHEMBL28659226 | 0.79 | ACACB (0.50) | ACACBMEN1KMT2AMAOBAOC3 | |
| SCHEMBL9713175 | 0.78 | L3MBTL1 (0.42) | RXRAGRIN1GRIN2BACACBMCHR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5164114-A | LIQUID CRYSTAL | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1992-11-17 | — | — | US | disclosed |