Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HRH1 | P35367 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | KAT2B | Q92831 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11438777 | 0.83 | MAPT (0.51) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| SCHEMBL6257167 | 0.82 | CHRNB2 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| SCHEMBL4425980 | 0.81 | AOC3 (0.40) | OPRM1L3MBTL1TDP1KMT2AKAT2B | |
| SCHEMBL173965 | 0.80 | SMN1; SMN2 (0.49) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| Hydrochloric Acid SCHEMBL4740359 | 0.79 | AOC3 (0.39) | OPRM1OPRD1MEN1KMT2AKAT2B | |
| SCHEMBL3829073 | 0.79 | OPRM1 (0.47) | OPRM1 | |
| Bromide SCHEMBL1980740 | 0.78 | SMN1; SMN2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| Iodide SCHEMBL29054398 | 0.78 | SMN1; SMN2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| Hydrochloric Acid SCHEMBL87594 | 0.78 | SMN1; SMN2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 | |
| Water SCHEMBL2110704 | 0.78 | SMN1; SMN2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2099762-A1 | ANTIBACTERIAL QUINOLINE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008068266-A1 | ANTIBACTERIAL QUINOLINE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-06-12 | — | — | WO | disclosed |