Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.41 |
| ▸ | RORC | P51449 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8633916 | 0.75 | ADRB2 (0.35) | ITGB3ITGA2BCHRM1 | |
| SCHEMBL8634088 | 0.75 | ITGB3 (0.36) | ITGB3ITGA2BRORCKDM4EGAA | |
| SCHEMBL8636968 | 0.72 | DRD4 (0.45) | RORC | |
| SCHEMBL8634075 | 0.72 | RORC (0.45) | RORC | |
| SCHEMBL8636260 | 0.71 | SPHK1 (0.35) | ITGB3ITGA2BRORCCHRM1TSHR | |
| SCHEMBL8636258 | 0.67 | OPRM1 (0.36) | ITGB3ITGA2BRORCCHRM1SPHK1 | |
| Hydrochloric Acid SCHEMBL8837964 | 0.66 | ITGB3 (0.45) | ITGB3ITGA2BTSHRCYP2C9 | |
| SCHEMBL7400370 | 0.65 | PPARG (0.50) | ITGB3ITGA2BTSHRSPHK1CYP2C9 | |
| SCHEMBL8635262 | 0.65 | ITGB3 (0.48) | ITGB3ITGA2BKDM4EMAPTTSHR | |
| SCHEMBL8636975 | 0.63 | ITGB3 (0.39) | ITGB3ITGA2BKDM4EGAAMAPT |
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-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |