Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 2/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 5/20 | 0.42 |
| ▸ | ADAMTS5 | Q9UNA0 | 6/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.37 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP12 | P39900 | 1/20 | 0.37 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | ADAMTS1 | Q9UHI8 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | ADAMTS7 | Q9UKP4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9539045 | 0.82 | PDE7A (0.50) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9571241 | 0.81 | PDE7A (0.49) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9539196 | 0.81 | PDE7A (0.49) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9540154 | 0.80 | PDE7A (0.50) | PDE7AAKR1B1AKR1A1PGRIDO1 | |
| SCHEMBL9539947 | 0.79 | PDE7A (0.45) | PDE7AAKR1B1CYP46A1MEN1KMT2A | |
| SCHEMBL9539898 | 0.79 | PDE7A (0.47) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9539949 | 0.79 | PDE7A (0.47) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9541537 | 0.78 | PDE7A (0.46) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9542754 | 0.78 | PDE7A (0.46) | PDE7AAKR1B1ADAMTS5ADAM17ADAMTS4 | |
| SCHEMBL9541675 | 0.78 | PGR (0.35) | PDE7ACYP46A1MEN1KMT2APGR |
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 |