Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 11/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 11/20 | 0.39 |
| ▸ | TSHR | P16473 | 9/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.39 |
| ▸ | USP2 | O75604 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30563791 | 0.88 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL25372831 | 0.85 | BCDIN3D (0.39) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL25372827 | 0.85 | BCDIN3D (0.39) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL18109523 | 0.81 | TLR8 (0.58) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL18109519 | 0.81 | TLR8 (0.58) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL18109502 | 0.80 | TLR8 (0.47) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL21983406 | 0.80 | TLR8 (0.58) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL18109504 | 0.80 | TLR8 (0.47) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL22569047 | 0.80 | TLR8 (0.59) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL25069298 | 0.80 | TLR8 (0.47) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 |
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-116693527-A | Pyrimido aromatic ring compounds and application thereof in medicines | 广东东阳光药业股份有限公司 | 2023-09-05 | — | — | CN | disclosed |