Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CPA1 | P15085 | 5/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 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 | |
|---|---|---|---|---|
| SCHEMBL8331176 | 0.83 | FDPS (0.47) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL4371898 | 0.79 | SLC6A2 (0.48) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL1828129 | 0.78 | SMN1; SMN2 (0.42) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL30331135 | 0.78 | FDPS (0.46) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL9617912 | 0.76 | SMN1; SMN2 (0.50) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL10717351 | 0.76 | SMN1; SMN2 (0.50) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| Phenol SCHEMBL28311359 | 0.76 | FNTA (0.42) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL3293297 | 0.75 | SLC6A2 (0.48) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL3202580 | 0.73 | CYP1A2 (0.45) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 | |
| SCHEMBL14935688 | 0.73 | SMN1; SMN2 (0.56) | FDPSCYP1A2CYP2C19CYP2C9SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3246307-A1 | METHOD FOR PRODUCING DIAMINE PRECURSOR COMPOUND | Nissan Chemical Industries, Ltd. (JP) | 2017-11-22 | — | — | EP | disclosed |