Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 4/20 | 0.59 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.59 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.58 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.58 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.56 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.56 |
| ▸ | TNKS | O95271 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | PLD2 | O14939 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29198253 | 1.00 | OPRM1 (0.59) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL319049 | 0.88 | CHRM1 (0.70) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL20302189 | 0.84 | CHRM2 (0.55) | OPRM1CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL20334172 | 0.84 | CHRM2 (0.55) | OPRM1CHRM1CHRM2CHRM4CHRM3 | |
| SCHEMBL20334166 | 0.84 | ALDH1A1 (0.54) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL20302481 | 0.84 | ALDH1A1 (0.54) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL7511954 | 0.84 | SLC18A3 (0.64) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL16444494 | 0.82 | ALDH1A1 (0.64) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL16444493 | 0.82 | ALDH1A1 (0.64) | OPRM1OPRK1OPRL1CHRM1CHRM2 | |
| SCHEMBL1833332 | 0.82 | HSD11B1 (0.68) | OPRM1OPRK1OPRL1CHRM1CHRM2 |
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-112074511-B | Substituted benzodiazoles and their use in therapy | 托马斯·黑勒戴药物研究基金会 | 2024-04-26 | — | — | CN | disclosed |