Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 7/20 | 0.74 |
| ▸ | NPC1 | O15118 | 3/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.72 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.72 |
| ▸ | RELA | Q04206 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 6/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.55 |
| ▸ | ACR | P10323 | 1/20 | 0.55 |
| ▸ | STAT3 | P40763 | 1/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9650560 | 0.96 | LMNA (0.79) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9650520 | 0.90 | CCNC (0.60) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13873590 | 0.85 | LMNA (0.92) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13873585 | 0.85 | LMNA (0.92) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13873588 | 0.85 | LMNA (0.92) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9787309 | 0.85 | LMNA (0.92) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL10615018 | 0.85 | CYP2D6 (0.66) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13937931 | 0.84 | POLB (0.59) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL13937930 | 0.84 | POLB (0.59) | LMNANPC1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9650532 | 0.84 | ABCG2 (0.65) | LMNANPC1CYP1A2CYP2C9CYP2C19 |
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 |