Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | PARP1 | P09874 | 3/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.48 |
| ▸ | NAPEPLD | Q6IQ20 | 1/20 | 0.46 |
| ▸ | PARG | Q86W56 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 4/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | SIRT6 | Q8N6T7 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.40 |
| ▸ | DNASE1 | P24855 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL14339171 | 0.82 | CA12 (0.50) | CA12CA9KDM4EPARP1PDE3A | |
| SCHEMBL17434450 | 0.76 | CA12 (0.54) | CA12CA9KDM4EPARP1PDE3A | |
| SCHEMBL9505259 | 0.76 | PARP1 (0.52) | KDM4EPARP1BRD4ALDH1A1HPGD | |
| SCHEMBL404118 | 0.72 | PARP1 (0.56) | CA12CA9KDM4EPARP1ALDH1A1 | |
| SCHEMBL182445 | 0.72 | JAK2 (0.60) | CA12CA9KDM4EPARP1PARG | |
| SCHEMBL1383605 | 0.72 | CA12 (0.54) | CA12CA9KDM4EPARP1PDE3A | |
| SCHEMBL3666779 | 0.72 | CA12 (0.54) | CA12CA9KDM4EPARP1PDE3A | |
| SCHEMBL4610600 | 0.72 | PARP1 (0.62) | CA12CA9KDM4EPARP1PDE3A | |
| SCHEMBL2255076 | 0.72 | ALDH1A1 (0.56) | CA12CA9KDM4EPARP1PARG | |
| SCHEMBL14409799 | 0.72 | CA12 (0.54) | CA12CA9KDM4EPARP1PDE3A |
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-3960735-B1 | QUINAZOLINE DERIVATIVES USED TO TREAT HIV | GILEAD SCIENCES INC (US) | 2023-09-13 | — | — | EP | disclosed |
| EP-3521282-A1 | QUINAZOLINE DERIVATIVES USED TO TREAT HIV | Gilead Sciences, Inc. (US) | 2019-08-07 | — | — | EP | disclosed |