Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.54 |
| ▸ | RELA | Q04206 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | RARB | P10826 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13038243 | 0.88 | LMNA (0.64) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL13325797 | 0.85 | NPC1 (0.64) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL30132301 | 0.85 | NPC1 (0.64) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL3616954 | 0.85 | NPC1 (0.64) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL8377915 | 0.85 | NPC1 (0.64) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL13038193 | 0.84 | LMNA (0.59) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL9649501 | 0.84 | RARB (0.68) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL6522875 | 0.83 | RARB (0.70) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL8971229 | 0.83 | RARB (0.70) | NPC1LMNANFKB1NFKB2RELA | |
| SCHEMBL8970737 | 0.83 | RARB (0.70) | NPC1LMNANFKB1NFKB2RELA |
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 |
|---|---|---|---|---|---|---|---|
| US-5139696-A | Hydrogen-bonded liquid crystal complexes | CORNELL RESEARCH FOUNDATION, INC. (US) | 1992-08-18 | — | — | US | disclosed |
| US-5037574-A | Hydrogen-bonded liquid crystal complexes | CORNELL RESEARCH FOUNDATION, INC. (US) | 1991-08-06 | — | — | US | disclosed |