Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.40 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3237494 | 0.82 | CA2 (0.62) | CA2CYP2A6HTR6LMNAAKR1B1 | |
| SCHEMBL31561597 | 0.82 | CA2 (0.62) | CA2CYP2A6HTR6LMNAAKR1B1 | |
| SCHEMBL7407839 | 0.81 | CNR1 (0.54) | CA2HTR6AKR1B1CNR1 | |
| SCHEMBL27867018 | 0.81 | KDM4E (0.47) | CA2HTR6LMNAAKR1B1KDM4E | |
| SCHEMBL5190594 | 0.81 | AKR1B1 (0.56) | CA2HTR6LMNAAKR1B1FFAR2 | |
| SCHEMBL8120975 | 0.81 | KDM4E (0.49) | CA2HTR6KDM4ECYP3A4CYP2C9 | |
| SCHEMBL4629441 | 0.80 | CA2 (0.57) | CA2HTR6LMNAAKR1B1ALDH1A1 | |
| SCHEMBL19260939 | 0.79 | KIF11 (0.43) | CA2CYP2A6HTR6AKR1B1CNR1 | |
| SCHEMBL17803693 | 0.79 | CA2 (0.42) | CA2HTR6AKR1B1CNR1 | |
| SCHEMBL9561474 | 0.78 | CYP19A1 (0.55) | CA2HTR6LMNAAKR1B1ALDH1A1 |
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-1444210-A1 | QUNAZOLINE DERIVATIVES AS ANTITUMOR AGENTS | AstraZeneca AB (SE) | 2004-08-11 | — | — | EP | disclosed |
| WO-2003040108-A1 | QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS | ASTRAZENECA AB (SE) | 2003-05-15 | — | — | WO | disclosed |