Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 3/20 | 0.70 |
| ▸ | NPC1 | O15118 | 3/20 | 0.67 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.67 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.67 |
| ▸ | RELA | Q04206 | 3/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.61 |
| ▸ | FAAH | O00519 | 6/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL8971229 | 0.97 | RARB (0.70) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL6522875 | 0.97 | RARB (0.70) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL8970737 | 0.97 | RARB (0.70) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL5705987 | 0.96 | NPC1 (0.72) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL7845911 | 0.96 | NPC1 (0.72) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL10524079 | 0.96 | NPC1 (0.72) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL27949668 | 0.96 | NPC1 (0.72) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL10608962 | 0.94 | NPC1 (0.71) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9182247 | 0.94 | NPC1 (0.74) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9478118 | 0.94 | NPC1 (0.74) | RARBNPC1LMNANFKB1NFKB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0327349-B1 | Liquid crystal compounds | SHOWA SHELL SEKIYU (JP) | 1996-04-10 | — | — | EP | claimed |