Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 9/20 | 0.67 |
| ▸ | PPARG | P37231 | 3/20 | 0.67 |
| ▸ | PPARD | Q03181 | 2/20 | 0.67 |
| ▸ | PPARA | Q07869 | 2/20 | 0.67 |
| ▸ | GABRP | O00591 | 2/20 | 0.64 |
| ▸ | GABRD | O14764 | 2/20 | 0.64 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.64 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.64 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.64 |
| ▸ | CCNC | P24863 | 2/20 | 0.64 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.64 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.64 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.64 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.64 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.64 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.64 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.64 |
| ▸ | CDK8 | P49336 | 2/20 | 0.64 |
| ▸ | GABRE | P78334 | 2/20 | 0.64 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL24827509 | 0.89 | CBS (0.68) | ABCB1PPARGPPARDPPARAGABRP | |
| SCHEMBL27719536 | 0.88 | PPARG (0.68) | ABCB1PPARGPPARDPPARAGABRP | |
| Norwogonin SCHEMBL30485998 | 0.81 | GABRP (0.68) | ABCB1PPARGPPARDPPARAGABRP | |
| Norwogonin SCHEMBL760431 | 0.81 | GABRP (0.68) | ABCB1PPARGPPARDPPARAGABRP | |
| SCHEMBL29149119 | 0.80 | ABCB1 (1.00) | ABCB1PPARGGABRPGABRDGABRA1 | |
| SCHEMBL17368660 | 0.79 | CDK5 (0.54) | ABCB1PPARGGABRPGABRDGABRA1 | |
| SCHEMBL28066043 | 0.79 | GABRP (0.65) | ABCB1PPARGPPARDPPARAGABRP | |
| SCHEMBL29149073 | 0.79 | GABRP (0.70) | ABCB1PPARGPPARDPPARAGABRP | |
| SCHEMBL21145437 | 0.78 | ABCB1 (0.65) | ABCB1PPARGPPARDPPARAGABRP | |
| Wogonin SCHEMBL29632729 | 0.78 | GABRP (1.00) | ABCB1GABRPGABRDGABRA1GABRB1 |
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-117447402-A | Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof | 德明药泰生物技术（深圳）有限公司 | 2024-01-26 | — | — | CN | disclosed |