Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 7/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8609019 | 0.87 | TSHR (0.48) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL29663153 | 0.87 | TSHR (0.48) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9627745 | 0.83 | RARB (0.48) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9626761 | 0.83 | RARB (0.48) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9557208 | 0.83 | RARB (0.46) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9405799 | 0.83 | RARB (0.54) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL9475541 | 0.83 | RARB (0.54) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL10524743 | 0.82 | RARB (0.49) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL10526601 | 0.82 | RARB (0.49) | RARBNPC1LMNANFKB1NFKB2 | |
| SCHEMBL10526454 | 0.82 | RARB (0.49) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2196754-A | — | — | None | — | — | JP | disclosed |
| JP-H02196754-A | NEW HALOGEN-CONTAINING ESTER COMPOUND, LIQUID CRYSTAL COMPOSITION AND OPTICAL SWITCHING ELEMENT CONTAINING THE SAME, INTERMEDIATE FOR THE SAME COMPOUND AND PRODUCTION THEREOF | NIPPON MINING CO LTD | 1990-08-03 | — | — | JP | disclosed |