Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 10/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 10/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | LSS | P48449 | 1/20 | 0.41 |
| ▸ | CHKA | P35790 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL785864 | 0.80 | ITGB3 (0.43) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL4435638 | 0.76 | ITGB3 (0.46) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL27557817 | 0.75 | ITGB3 (0.51) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL7015824 | 0.75 | ITGB3 (0.51) | ITGB3ITGA2BHRH3LSSDPP4 | |
| Benzene SCHEMBL27559018 | 0.74 | KDM1A (0.53) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL20051535 | 0.72 | NOTUM (0.46) | TSHR | |
| SCHEMBL742952 | 0.72 | ITGB3 (0.60) | ITGB3ITGA2BLSSCHKA | |
| SCHEMBL7334680 | 0.72 | CHKA (0.52) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL8631652 | 0.72 | ITGB3 (0.51) | ITGB3ITGA2BHRH3LSSCHKA | |
| SCHEMBL785158 | 0.71 | F10 (0.53) | ITGB3ITGA2B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |