Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGIR | P43119 | 7/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 3/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GRM3 | Q14832 | 3/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7288816 | 1.00 | PTGIR (0.37) | PTGIRPTGDRITGB3ITGA2BCHRNB2 | |
| SCHEMBL7289057 | 1.00 | PTGIR (0.37) | PTGIRPTGDRITGB3ITGA2BCHRNB2 | |
| SCHEMBL4434030 | 0.84 | ALDH1A1 (0.43) | CHRNB2CHRNA4ALDH1A1GRM3CHRNB4 | |
| SCHEMBL7288803 | 0.82 | MEN1 (0.49) | ALDH1A1 | |
| SCHEMBL3655590 | 0.81 | POLB (0.44) | CHRNB2CHRNA4ALDH1A1GRM3CHRNB4 | |
| SCHEMBL3778464 | 0.81 | POLB (0.44) | CHRNB2CHRNA4ALDH1A1GRM3CHRNB4 | |
| SCHEMBL22319904 | 0.80 | PDK1 (0.37) | CHRNB2CHRNA4ALDH1A1GRM3CHRNB4 | |
| SCHEMBL22366358 | 0.80 | PDK1 (0.37) | CHRNB2CHRNA4ALDH1A1GRM3CHRNB4 | |
| SCHEMBL8578265 | 0.80 | RAB9A (0.40) | CHRNB2CHRNA4CYP4F2CYP4A11ALDH1A1 | |
| SCHEMBL8574641 | 0.80 | PDK1 (0.43) | CYP4F2CYP4A11ALDH1A1GRM3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0928793-B1 | Thiazole derivatives | HOFFMANN LA ROCHE (CH) | 2002-05-15 | — | — | EP | disclosed |
| US-6001855-A | REACTING A THIAZOLE DERIVATIVE AND A CYCLIC AMINE DERIVATIVE; INHIBITS BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES OF CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS | HOFFMAN-LA ROCHE INC. (US) | 1999-12-14 | — | — | US | disclosed |
| EP-0928793-A1 | Thiazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1999-07-14 | — | — | EP | disclosed |