Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 2/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 7/20 | 0.35 |
| ▸ | HTR3A | P46098 | 7/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20135156 | 1.00 | SIGMAR1 (0.46) | SIGMAR1OPRM1DRD2TP53TDP1 | |
| SCHEMBL1266110 | 0.86 | SIGMAR1 (0.46) | SIGMAR1OPRM1DRD2TDP1GABRD | |
| SCHEMBL750271 | 0.84 | SIGMAR1 (0.45) | SIGMAR1OPRM1DRD2 | |
| SCHEMBL11962819 | 0.83 | PRKAB2 (0.40) | OPRM1DRD2TP53TDP1DRD4 | |
| SCHEMBL13467506 | 0.83 | TP53 (0.40) | OPRM1DRD2TP53TDP1DRD4 | |
| SCHEMBL655261 | 0.83 | DRD2 (0.54) | SIGMAR1OPRM1DRD2HTR1APRKAB2 | |
| SCHEMBL4701018 | 0.80 | HTR1A (0.50) | SIGMAR1OPRM1DRD2TP53HTR1A | |
| SCHEMBL2271940 | 0.79 | SIGMAR1 (0.44) | SIGMAR1OPRM1DRD2GABRDGABRA1 | |
| SCHEMBL14676690 | 0.79 | RAB9A (0.38) | OPRM1DRD2TP53TDP1ALDH1A1 | |
| SCHEMBL2270935 | 0.78 | SIGMAR1 (0.62) | SIGMAR1OPRM1DRD2ADRB1HTR2C |
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-107922347-B | Novel imide derivatives and their use as pharmaceuticals | 田边三菱制药株式会社 | 2022-06-28 | — | — | CN | disclosed |