Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27305131 | 0.83 | SIGMAR1 (0.49) | TP53SIGMAR1OPRM1DRD3KCNH2 | |
| SCHEMBL18928110 | 0.79 | ALDH1A1 (0.48) | GRIN2DGRIN3BGRIN1GRIN2AGRIN2B | |
| SCHEMBL21300666 | 0.79 | ALDH1A1 (0.46) | TP53ALDH1A1CES2CES1AKR1B1 | |
| SCHEMBL19405101 | 0.78 | TDP1 (0.69) | TP53POLBAPEX1TDP1ALOX5 | |
| SCHEMBL3631071 | 0.76 | POLB (0.60) | TP53POLBAPEX1TDP1ALOX5 | |
| SCHEMBL2721394 | 0.74 | REN (0.69) | POLBAPEX1TDP1RORCALOX5 | |
| SCHEMBL21078085 | 0.73 | TP53 (0.47) | TP53SIGMAR1TDP1ALDH1A1CES2 | |
| SCHEMBL11339635 | 0.73 | CES1 (0.50) | TP53ALDH1A1CES2CES1AKR1B1 | |
| SCHEMBL531194 | 0.73 | CES1 (0.50) | TP53ALDH1A1CES2CES1AKR1B1 | |
| Benzene SCHEMBL9806260 | 0.73 | CES1 (0.50) | TP53ALDH1A1CES2CES1AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009130017-A1 | JUNCTIONS COMPRISING MOLECULAR BILAYERS FOR THE USE IN ELECTRONIC DEVICES | SONY CORPORATION (JP) | 2009-10-29 | — | — | WO | disclosed |