Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | SI | P14410 | 3/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.33 |
| ▸ | SRC | P12931 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8598142 | 0.90 | CYP19A1 (0.38) | MGAMGAASIMGAM2CYP2D6 | |
| SCHEMBL8598478 | 0.89 | AAK1 (0.32) | — | |
| SCHEMBL8599898 | 0.87 | — | — | |
| SCHEMBL8598099 | 0.86 | CYP2D6 (0.38) | MGAMGAASIMGAM2CYP2D6 | |
| SCHEMBL8601719 | 0.82 | DCTPP1 (0.33) | MGAMGAASIMGAM2 | |
| SCHEMBL7561123 | 0.82 | CYP2D6 (0.40) | MGAMGAASIMGAM2CYP2D6 | |
| SCHEMBL8604072 | 0.82 | CYP2D6 (0.40) | MGAMGAASIMGAM2CYP2D6 | |
| SCHEMBL7554909 | 0.81 | ALDH1A1 (0.38) | SRCABL1CYP2D6 | |
| SCHEMBL8597467 | 0.81 | SRC (0.33) | MGAMGAASIMGAM2SRC | |
| SCHEMBL7558906 | 0.81 | CYP2D6 (0.36) | GAASRCABL1CYP2D6MAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |