Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | ANPEP | P15144 | 1/20 | 0.31 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.31 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.31 |
| ▸ | SLC6A11 | P48066 | 2/20 | 0.31 |
| ▸ | SLC6A13 | Q9NSD5 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.31 |
| ▸ | RBP4 | P02753 | 1/20 | 0.31 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27722913 | 0.91 | TDP1 (0.50) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27702406 | 0.89 | TDP1 (0.48) | TDP1ITGB3ITGA2BSLC6A4KDM1A | |
| Tert-Butyl Formate SCHEMBL27721981 | 0.88 | TDP1 (0.43) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27663311 | 0.86 | TDP1 (0.45) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27779744 | 0.85 | TDP1 (0.41) | TDP1ITGB3ITGA2BSLC6A4ANPEP | |
| Tert-Butyl Formate SCHEMBL27712414 | 0.85 | TDP1 (0.43) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27765046 | 0.85 | TDP1 (0.43) | TDP1KDM1AANPEPERAP2SLC6A1 | |
| Tert-Butyl Formate SCHEMBL27807820 | 0.85 | TDP1 (0.43) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27562936 | 0.85 | TDP1 (0.43) | TDP1ITGB3ITGA2BKDM1AANPEP | |
| Tert-Butyl Formate SCHEMBL27721999 | 0.84 | TDP1 (0.46) | TDP1ITGB3ITGA2BKDM1AANPEP |
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 |
|---|---|---|---|---|---|---|---|
| CN-105229009-A | 2-phenylimidazo [1,2-A ] pyrimidines as imaging agents | HOFFMANN LA ROCHE | 2016-01-06 | — | — | CN | disclosed |