Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 14/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 10/20 | 0.33 |
| ▸ | RXRA | P19793 | 7/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9763981 | 0.90 | RXRA (0.37) | ACACBGRIN2BGRIN1RXRANPC1 | |
| SCHEMBL9764309 | 0.85 | RAB9A (0.43) | GRIN2BNPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL9763609 | 0.82 | RARB (0.46) | NPC1RAB9ASMN1; SMN2TP53PKM | |
| SCHEMBL10719819 | 0.81 | GRIN2B (0.43) | ACACBGRIN2BGRIN1RXRANPC1 | |
| SCHEMBL9507105 | 0.81 | RARB (0.51) | NPC1RAB9ASMN1; SMN2TP53PKM | |
| SCHEMBL9511660 | 0.81 | TRPV4 (0.39) | ACACBSMN1; SMN2 | |
| SCHEMBL9763848 | 0.80 | RARB (0.54) | NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL9763897 | 0.80 | RARB (0.54) | NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL9763490 | 0.80 | RARB (0.54) | NPC1RAB9ASMN1; SMN2HSD17B10 | |
| SCHEMBL15829128 | 0.80 | ACACB (0.34) | ACACBGRIN2BGRIN1RXRA |
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-5032313-A | Trifluorobenzene derivative and liquid crystal composition containing the same | CHISSO CORPORATION (JP) | 1991-07-16 | — | — | US | disclosed |