Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.54 |
| ▸ | DRD4 | P21917 | 2/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | KCNA3 | P22001 | 3/20 | 0.43 |
| ▸ | CCR3 | P51677 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.41 |
| ▸ | EBP | Q15125 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3979738 | 0.87 | CYP2D6 (0.58) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL27839435 | 0.81 | CYP2D6 (0.49) | DRD2DRD4OPRM1DRD3ATM | |
| Phosphoric Acid SCHEMBL28059412 | 0.77 | OPRM1 (0.49) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL18940705 | 0.75 | DRD2 (0.42) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL27973295 | 0.74 | TSHR (0.41) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL1343715 | 0.74 | ATM (0.81) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL4014770 | 0.72 | DRD2 (0.65) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL6258542 | 0.71 | DRD2 (0.68) | DRD2DRD4OPRM1DRD3ATM | |
| SCHEMBL14574057 | 0.71 | MAOA (0.43) | ATMMAOAMAOB | |
| SCHEMBL22728397 | 0.71 | OPRM1 (0.44) | DRD2DRD4OPRM1DRD3ATM |
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-105658621-B | 4-aminomethyl benzoic acid derivatives | 东亚荣养株式会社 | 2018-05-29 | — | — | CN | disclosed |