Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 15/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 4/20 | 0.40 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28141157 | 0.90 | BCAT2 (0.43) | BCAT2TBXAS1ALDH1A1GAAPLOD2 | |
| SCHEMBL63954 | 0.84 | CES1 (0.50) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6166969 | 0.82 | TBXAS1 (0.59) | HCAR2TBXAS1ALDH1A1APPGAA | |
| Hydrochloric Acid SCHEMBL6166975 | 0.82 | TBXAS1 (0.59) | HCAR2TBXAS1ALDH1A1APPGAA | |
| Hydrochloric Acid SCHEMBL6167657 | 0.82 | TBXAS1 (0.59) | HCAR2TBXAS1ALDH1A1APPGAA | |
| Hydrochloric Acid SCHEMBL4398755 | 0.82 | NFE2L2 (0.48) | ALDH1A1 | |
| SCHEMBL8937507 | 0.81 | KMT2A (0.61) | TBXAS1ALDH1A1PLOD2CYP19A1CYP11B2 | |
| SCHEMBL8937512 | 0.81 | KMT2A (0.61) | TBXAS1ALDH1A1PLOD2CYP19A1CYP11B2 | |
| SCHEMBL8937855 | 0.81 | KMT2A (0.61) | TBXAS1ALDH1A1PLOD2CYP19A1CYP11B2 | |
| SCHEMBL16464023 | 0.75 | HCAR2 (0.53) | HCAR2TBXAS1TBXA2R |
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-2010038081-A2 | HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF | ASTRAZENECA AB (SE) | 2010-04-08 | — | — | WO | disclosed |