Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPA5 | P11021 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | PYCR1 | P32322 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2870972 | 0.86 | CALM1 (0.46) | — | |
| SCHEMBL4170188 | 0.82 | TRPA1 (0.36) | CYP1A1CYP1A2CYP1B1PYCR1PNMT | |
| SCHEMBL26987968 | 0.81 | PYCR1 (0.39) | PYCR1TAAR1 | |
| SCHEMBL7061714 | 0.80 | ALDH1A1 (0.38) | CYP1A1CYP1A2CYP1B1PYCR1PNMT | |
| SCHEMBL149728 | 0.80 | APOBEC3G (0.43) | HSPA5CYP1A1CYP1A2CYP1B1PYCR1 | |
| SCHEMBL4953056 | 0.80 | GABRA1 (0.46) | PYCR1GABRA1GABRB2 | |
| SCHEMBL1253891 | 0.80 | CYP1A1 (0.33) | CYP1A1CYP1A2CYP1B1PYCR1GABRA1 | |
| SCHEMBL6679575 | 0.80 | IDO1 (0.50) | CYP1A1CYP1A2CYP1B1PYCR1PNMT | |
| SCHEMBL20838091 | 0.80 | CYP1A1 (0.33) | CYP1A1CYP1A2CYP1B1PYCR1PNMT | |
| SCHEMBL3973809 | 0.80 | PNMT (0.50) | CYP1A1CYP1A2CYP1B1PYCR1PNMT |
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-1991009066-A1 | HIGH CARBON RESINS AND FOAMS | HYPERION CATALYSIS INTERNATIONAL, INC. (US) | 1991-06-27 | — | — | WO | disclosed |