Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 9/20 | 0.46 |
| ▸ | CBX7 | O95931 | 1/20 | 0.44 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27311876 | 0.89 | MDM2 (0.55) | SCN9AMDM2TP53MAPT | |
| SCHEMBL11882562 | 0.83 | MDM2 (0.54) | MDM2CBX7CDYL | |
| SCHEMBL9539179 | 0.82 | ADAMTS5 (0.42) | SCN9AMDM2CBX7CDYLADAMTS5 | |
| SCHEMBL11388713 | 0.82 | MDM2 (0.46) | MDM2CBX7CDYL | |
| SCHEMBL9540109 | 0.82 | TP53 (0.43) | SCN9AMDM2CBX7CDYLADAMTS5 | |
| SCHEMBL30877037 | 0.77 | HSD11B1 (0.48) | MDM2PTGDR2 | |
| SCHEMBL27311873 | 0.77 | HSD11B1 (0.48) | MDM2PTGDR2 | |
| SCHEMBL2474367 | 0.77 | MDM2 (0.41) | MDM2MAPT | |
| SCHEMBL9541565 | 0.75 | AKR1B1 (0.51) | MDM2MAPT | |
| SCHEMBL1819302 | 0.75 | MDM2 (0.82) | SCN9AMDM2 |
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 |