Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | GNAO1 | P09471 | 5/20 | 0.36 |
| ▸ | GNAI3 | P08754 | 4/20 | 0.36 |
| ▸ | GNAI1 | P63096 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7119085 | 0.90 | KDM4E (0.36) | KEAP1SMN1; SMN2HRH3GNAO1GNAI3 | |
| SCHEMBL7119089 | 0.75 | GNAO1 (0.51) | KEAP1SMN1; SMN2HRH3GNAO1GNAI3 | |
| SCHEMBL6408637 | 0.74 | KEAP1 (0.58) | KEAP1SMN1; SMN2HRH3CYP1A2HPGD | |
| SCHEMBL5848078 | 0.74 | CXCR4 (0.37) | SMN1; SMN2HRH3GNAO1GNAI3GNAI1 | |
| SCHEMBL7887988 | 0.73 | GNAO1 (0.54) | KEAP1SMN1; SMN2HRH3GNAO1GNAI3 | |
| SCHEMBL3950022 | 0.73 | SLC6A2 (0.31) | HRH3 | |
| SCHEMBL6674597 | 0.73 | SMN1; SMN2 (0.56) | KEAP1SMN1; SMN2HRH3HPGDDUSP3 | |
| SCHEMBL151418 | 0.73 | CXCR4 (0.57) | KEAP1SMN1; SMN2HRH3CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL8901169 | 0.72 | GNAO1 (0.56) | KEAP1SMN1; SMN2HRH3GNAO1GNAI3 | |
| SCHEMBL15173760 | 0.71 | KEAP1 (0.54) | KEAP1SMN1; SMN2HRH3CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1119567-A1 | QUINAZOLINE DERIVATIVES | AstraZeneca AB (SE) | 2001-08-01 | — | — | EP | disclosed |
| WO-2000021955-A1 | QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2000-04-20 | — | — | WO | disclosed |