Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | STAT3 | P40763 | 2/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ESRRA | P11474 | 2/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29152055 | 0.81 | CA12 (0.38) | CA12CA1CA2CA9CA14 | |
| SCHEMBL29151972 | 0.81 | KMT2A (0.41) | CA12CA1CA2CA9CA14 | |
| SCHEMBL27716723 | 0.80 | IKBKB (0.46) | CA12CA1CA2CA9CA14 | |
| SCHEMBL5918245 | 0.75 | HPGD (0.54) | CA12CA1CA2CA9CA14 | |
| SCHEMBL1076006 | 0.73 | ALDH1A1 (0.43) | MAPTHPGDKMT2AMEN1 | |
| SCHEMBL11887260 | 0.73 | PARP10 (0.55) | CA12CA1CA2CA9CA14 | |
| SCHEMBL4466049 | 0.71 | CA12 (0.42) | CA12CA1CA2CA9CA14 | |
| SCHEMBL1555274 | 0.71 | SMN1; SMN2 (0.55) | CA1CA2MAPTHPGDRAB9A | |
| SCHEMBL16681319 | 0.70 | ELANE (0.36) | CA12CA1CA2CA9CA14 | |
| SCHEMBL9467858 | 0.70 | CTNNB1 (0.57) | MAPTRAB9ACTNNB1KMT2AMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116987061-A | 4-methyl quinazoline derivative, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-11-03 | — | — | CN | disclosed |