Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | PEPD | P12955 | 1/20 | 0.39 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 4/20 | 0.34 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.34 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29827776 | 1.00 | NR1H2 (0.39) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL29144815 | 1.00 | NR1H2 (0.39) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL29947782 | 1.00 | NR1H2 (0.39) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL19484833 | 1.00 | NR1H2 (0.39) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL3552873 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL476146 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL2995724 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL3554330 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL3643891 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 | |
| SCHEMBL18591298 | 0.91 | PEPD (0.48) | NR1H2PEPDXPNPEP1CHRM2CHRM1 |
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-117255684-A | Quinazolinamine derivatives as KRAS inhibitors | 尼坎治疗公司 | 2023-12-19 | — | — | CN | disclosed |