Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 5/20 | 0.36 |
| ▸ | JUN | P05412 | 3/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.36 |
| ▸ | RELA | Q04206 | 3/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | XPO1 | O14980 | 2/20 | 0.32 |
| ▸ | ATF1 | P18846 | 2/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.30 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.30 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.30 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.30 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28205827 | 0.77 | PARP1 (0.38) | NFKB1JUNNFKB2RELAXPO1 | |
| SCHEMBL30475027 | 0.76 | NFKB1 (0.34) | NFKB1JUNNFKB2RELACYP11B1 | |
| SCHEMBL30782222 | 0.75 | ABL1 (0.33) | — | |
| SCHEMBL25329086 | 0.75 | RPS6KA5 (0.31) | — | |
| SCHEMBL27845839 | 0.75 | CYP11B1 (0.40) | CYP11B1CYP11B2XPO1KCNQ3KCNQ2 | |
| SCHEMBL438099 | 0.71 | TDP1 (0.35) | CYP11B1CYP11B2XPO1 | |
| SCHEMBL1633538 | 0.70 | NFKB1 (0.40) | NFKB1JUNNFKB2RELACYP11B1 | |
| SCHEMBL8596569 | 0.70 | XPO1 (0.36) | NFKB1JUNNFKB2RELACYP11B1 | |
| SCHEMBL30708475 | 0.70 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL2916466 | 0.68 | SMN1; SMN2 (0.36) | NFKB1ATF1KCNQ3KCNQ2KCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023143135-A1 | QUINAZOLINE DERIVATIVE AND USE THEREOF | 赛诺哈勃药业（成都）有限公司 | 2023-08-03 | — | — | WO | disclosed |
| CN-116514728-A | Quinazoline derivative and application thereof | 赛诺哈勃药业（成都）有限公司 | 2023-08-01 | — | — | CN | disclosed |