Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11665099 | 0.81 | MEN1 (0.60) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL16109476 | 0.74 | TP53 (0.47) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL5563199 | 0.69 | MDM2 (0.41) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL5555500 | 0.69 | MEN1 (0.47) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL5562497 | 0.69 | MEN1 (0.42) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL16108517 | 0.67 | BRD4 (0.81) | BRD4PGR | |
| SCHEMBL16109306 | 0.65 | GAA (0.60) | MEN1KMT2ABRD4GAATP53 | |
| SCHEMBL11662300 | 0.65 | MEN1 (0.57) | MEN1KMT2ABRD4ATMGAA | |
| SCHEMBL11660779 | 0.65 | MEN1 (0.69) | MEN1KMT2AATMGAATSHR | |
| SCHEMBL24112733 | 0.65 | PGR (0.69) | MEN1KMT2AATMGAATSHR |
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-0530994-A1 | Quinazoline derivatives as inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1993-03-10 | — | — | EP | disclosed |
| WO-1993004047-A1 | QUINAZOLINE DERIVATIVES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE | MERCK & CO., INC. (US) | 1993-03-04 | — | — | WO | disclosed |