Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8104652 | 0.94 | TDP1 (0.41) | TDP1CYP2C9CYP2C19 | |
| SCHEMBL3931824 | 0.75 | — | — | |
| SCHEMBL4881270 | 0.72 | HRH3 (0.39) | — | |
| SCHEMBL8104876 | 0.71 | KEAP1 (0.40) | — | |
| SCHEMBL6355310 | 0.65 | TDP1 (0.48) | TDP1CYP2C9CYP2C19 | |
| SCHEMBL6137087 | 0.62 | TDP1 (0.44) | TDP1CYP2C9CYP2C19 | |
| SCHEMBL152212 | 0.61 | TDP1 (0.44) | TDP1CYP2C9CYP2C19 | |
| SCHEMBL28208452 | 0.60 | TDP1 (0.42) | TDP1CYP2C9CYP2C19 | |
| SCHEMBL19968188 | 0.60 | SLC6A2 (0.34) | — | |
| SCHEMBL28685038 | 0.59 | TDP1 (0.48) | TDP1CYP2C9CYP2C19 |
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-6015814-A | Quinazoline derivative | ZENECA LIMITED (GB) | 2000-01-18 | — | — | US | claimed |
| US-6015814-A | Quinazoline derivative | ZENECA LIMITED (GB) | 2000-01-18 | — | — | US | disclosed |