Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 6/20 | 0.68 |
| ▸ | CSK | P41240 | 1/20 | 0.57 |
| ▸ | BTK | Q06187 | 1/20 | 0.57 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.57 |
| ▸ | CAMK1G | Q96NX5 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 4/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.57 |
| ▸ | TP53 | P04637 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | CASP1 | P29466 | 3/20 | 0.57 |
| ▸ | CASP7 | P55210 | 3/20 | 0.57 |
| ▸ | HBB | P68871 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.57 |
| ▸ | PRNP | P04156 | 2/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.57 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.57 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.57 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL3971151 | 0.98 | CCR4 (0.68) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL3975275 | 0.93 | CCR4 (0.63) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL3979569 | 0.87 | CCR4 (0.55) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL6668299 | 0.86 | CCR4 (0.56) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL27599065 | 0.85 | CCR4 (0.56) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL4269216 | 0.85 | CYP2D6 (0.63) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL3974794 | 0.85 | CCR4 (0.61) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL3542141 | 0.84 | CCR4 (0.72) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL3542142 | 0.84 | CCR4 (0.72) | CCR4CSKBTKERBB4CAMK1G | |
| SCHEMBL17829849 | 0.83 | CCR4 (0.67) | CCR4CSKBTKERBB4CAMK1G |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004030672-A1 | USE OF 4 AMINO-QUINAZOLINES AS ANTI CANCER AGENTS | MERCK PATENT GMBH (DE) | 2004-04-15 | — | — | WO | disclosed |
| EP-1318984-A1 | 4-AMINO-QUINAZOLINES | MERCK PATENT GmbH (DE) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002024667-A1 | 4-AMINO-QUINAZOLINES | MERCK PATENT GMBH (DE) | 2002-03-28 | — | — | WO | disclosed |