Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.33 |
| ▸ | AR | P10275 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.33 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | AKT2 | P31751 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6216924 | 0.81 | POLB (0.54) | ALDH1A1SMN1; SMN2PDE4BARPOLB | |
| SCHEMBL24210848 | 0.73 | KCNH2 (0.40) | SMN1; SMN2NPSR1PDE4BARAKT1 | |
| SCHEMBL4733455 | 0.71 | CYP19A1 (0.53) | ALDH1A1SMN1; SMN2MAPTPDE4BPOLB | |
| SCHEMBL11332971 | 0.71 | MAPT (0.48) | SMN1; SMN2MAPTNPSR1PDE4BAR | |
| SCHEMBL2750417 | 0.71 | MAPT (0.44) | ALDH1A1SMN1; SMN2MAPTNPSR1AR | |
| SCHEMBL16969031 | 0.69 | AR (0.51) | ALDH1A1SMN1; SMN2MAPTNPSR1HTT | |
| SCHEMBL509280 | 0.68 | KCNH2 (0.41) | CYP19A1KDM4C | |
| SCHEMBL28439643 | 0.68 | MAPT (0.43) | ALDH1A1SMN1; SMN2MAPTNPSR1POLB | |
| SCHEMBL3251181 | 0.67 | CYP1A2 (0.43) | ALDH1A1SMN1; SMN2MAPTNPSR1HTT | |
| SCHEMBL2753440 | 0.67 | MAPT (0.42) | ALDH1A1SMN1; SMN2MAPTNPSR1AR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546132-A1 | PYRAZOLE DERIVATIVES AS REVERSE TRANSCRIPTASE INHIBITORS | Pfizer Limited (GB) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004029042-A1 | PYRAZOLE DERIVATIVES AS REVERSE TRANSCRIPTASE INHIBITORS | PFIZER LIMITED (GB) | 2004-04-08 | — | — | WO | disclosed |