Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL4854364 | 1.00 | IDO1 (0.46) | IDO1PDPK1PIN1SRD5A1SLC6A2 | |
| SCHEMBL16866691 | 0.82 | HTR2A (0.47) | IDO1PDPK1CYP2D6 | |
| SCHEMBL10283375 | 0.81 | DRD2 (0.47) | IDO1PDPK1PIN1SRD5A1CYP11B2 | |
| SCHEMBL12452014 | 0.81 | DRD2 (0.47) | IDO1PDPK1PIN1SRD5A1CYP11B2 | |
| SCHEMBL13998258 | 0.80 | IDO1 (0.44) | IDO1PDPK1PIN1SRD5A1CYP11B2 | |
| SCHEMBL15375784 | 0.80 | IDO1 (0.49) | IDO1PDPK1PIN1SLC6A2SLC6A4 | |
| SCHEMBL783972 | 0.80 | IDO1 (0.49) | IDO1PDPK1PIN1SRD5A1SIGMAR1 | |
| SCHEMBL17145170 | 0.77 | PRCP (0.44) | IDO1PDPK1PIN1SRD5A1CYP2D6 | |
| SCHEMBL802812 | 0.77 | PRCP (0.44) | IDO1PDPK1PIN1SRD5A1CYP2D6 | |
| SCHEMBL12452306 | 0.77 | PRCP (0.44) | IDO1PDPK1PIN1SRD5A1CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7420003-B2 | reacting oxabenzonorbornadiene with nucleophiles;in presence of rhodium complex catalyst forming 2-pyrrolidin-1-ol-1,2-dihydronaphthalen-1-ol; drug used as analgesics, Parkinson's disease, anticancer agents; aids | ASTRAZENECA AB (SE) | 2008-09-02 | — | — | US | disclosed |
| US-7420003-B2 | reacting oxabenzonorbornadiene with nucleophiles;in presence of rhodium complex catalyst forming 2-pyrrolidin-1-ol-1,2-dihydronaphthalen-1-ol; drug used as analgesics, Parkinson's disease, anticancer agents; aids | ASTRAZENECA AB (SE) | 2008-09-02 | — | — | US | disclosed |