Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.45 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.40 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MC4R | P32245 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8188051 | 0.84 | CYP1A2 (0.65) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL8178310 | 0.84 | CYP1A2 (0.65) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL8177836 | 0.84 | CYP1A2 (0.65) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL742603 | 0.81 | CYP1A2 (0.56) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL9105247 | 0.80 | ALDH1A1 (0.63) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Felbamate SCHEMBL2946508 | 0.79 | CYP1A2 (1.00) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Felbamate SCHEMBL34947 | 0.79 | CYP1A2 (1.00) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| SCHEMBL28211506 | 0.79 | ALDH1A1 (0.81) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Felbamate SCHEMBL7153063 | 0.78 | CYP1A2 (0.96) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 | |
| Felbamate SCHEMBL17597519 | 0.78 | CYP1A2 (0.96) | CYP1A2CYP2D6PKMSMN1; SMN2NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-11310556-A | — | — | None | — | — | JP | disclosed |