Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 15/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 15/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 13/20 | 0.52 |
| ▸ | TSHR | P16473 | 13/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 13/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 7/20 | 0.52 |
| ▸ | LMNA | P02545 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 8/20 | 0.51 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.47 |
| ▸ | APLNR | P35414 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL23981519 | 1.00 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL30273296 | 1.00 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL23981521 | 0.84 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL23981684 | 0.82 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL30066179 | 0.82 | CYP1A2 (0.50) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL25583132 | 0.82 | CYP1A2 (0.49) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL25254910 | 0.81 | PDE4B (0.47) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL30396968 | 0.81 | PDE4B (0.47) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL16992875 | 0.81 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19TSHRCYP2D6 | |
| SCHEMBL23981856 | 0.80 | PDE4B (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-115996908-A | Antagonists of GPR39 proteins | 俄勒冈健康科学大学 | 2023-04-21 | — | — | CN | disclosed |