Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12837474 | 0.79 | CYP1A2 (0.42) | CYP1A2PTPN1CYP2D6CHRM1CHRM4 | |
| SCHEMBL4551817 | 0.78 | CYP1A2 (0.41) | CYP1A2PTPN1CYP2D6CHRM1CHRM4 | |
| SCHEMBL3261996 | 0.75 | CYP1A2 (0.42) | CYP1A2PTPN1CYP2D6CHRM1CHRM4 | |
| SCHEMBL19812943 | 0.70 | ALDH1A1 (0.46) | CYP1A2CYP2D6CHRM1ALDH1A1TSHR | |
| SCHEMBL1843172 | 0.70 | KIF11 (0.43) | CYP1A2CYP2D6ALDH1A1S1PR4LMNA | |
| SCHEMBL19812940 | 0.69 | CYP2C19 (0.44) | CYP1A2PTPN1CYP2D6CHRM1CHRM4 | |
| SCHEMBL29010065 | 0.68 | CYP1A2 (0.42) | CYP1A2PTPN1CYP2D6ALDH1A1TSHR | |
| SCHEMBL2699401 | 0.68 | MAPT (0.48) | PTPN1CYP2D6CHRM1ALDH1A1LMNA | |
| SCHEMBL28147722 | 0.67 | CYP1A2 (0.45) | CYP1A2PTPN1CYP2D6ALDH1A1TSHR | |
| SCHEMBL27528437 | 0.67 | CES1 (0.50) | PTPN1ALDH1A1TSHRS1PR4LMNA |
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-116209433-A | Small molecule albumin binding agents | 俄勒冈健康科学大学 | 2023-06-02 | — | — | CN | disclosed |