Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4034325 | 0.89 | ALDH1A1 (0.39) | ADRB2ADRB1ADRB3TDP1ALDH1A1 | |
| SCHEMBL4031912 | 0.81 | ALDH1A1 (0.51) | TDP1ALDH1A1CYP3A4ALOX15SMN1; SMN2 | |
| SCHEMBL27731315 | 0.76 | NR1H4 (0.58) | ADRB2ADRB1ADRB3TDP1ALDH1A1 | |
| SCHEMBL8211411 | 0.75 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1MAPTGAA | |
| SCHEMBL3870375 | 0.74 | ALDH1A1 (0.49) | TDP1ALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6771753 | 0.74 | HTT (0.44) | ADRB2ADRB1ADRB3TDP1ALDH1A1 | |
| SCHEMBL12742256 | 0.72 | ALDH1A1 (0.53) | TDP1ALDH1A1CYP3A4ALOX15SMN1; SMN2 | |
| SCHEMBL5718688 | 0.72 | ALDH1A1 (0.50) | TDP1ALDH1A1CYP3A4ALOX15SMN1; SMN2 | |
| SCHEMBL20302648 | 0.71 | TDP1 (0.53) | TDP1ALDH1A1CYP3A4SMN1; SMN2KMT2A | |
| SCHEMBL30166675 | 0.71 | TDP1 (0.53) | TDP1ALDH1A1CYP3A4SMN1; SMN2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-100343238-C | Quinazoline derivatives as antitumor agents | ASTRAZENECA AB (SE) | 2007-10-17 | — | — | CN | disclosed |
| CN-1585754-A | Quinazoline derivatives as antitumor agents | ASTRAZENECA AB (SE) | 2005-02-23 | — | — | CN | disclosed |