Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.51 |
| ▸ | USP2 | O75604 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.42 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | INSR | P06213 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 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 | |
|---|---|---|---|---|
| SCHEMBL5224506 | 0.92 | ALDH1A1 (0.51) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 | |
| SCHEMBL5229173 | 0.82 | DRD4 (0.47) | ALDH1A1LMNASMN1; SMN2TP53DRD4 | |
| SCHEMBL5230509 | 0.81 | POLB (0.41) | ALDH1A1SMN1; SMN2TP53TSHRPOLB | |
| SCHEMBL2761292 | 0.78 | LCK (0.41) | ALDH1A1SMN1; SMN2POLBLCKMAP4K3 | |
| SCHEMBL5222920 | 0.76 | ALDH1A1 (0.41) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 | |
| SCHEMBL2761054 | 0.76 | MAPT (0.43) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 | |
| SCHEMBL5228465 | 0.74 | SMO (0.46) | ALDH1A1LMNAUSP2SMN1; SMN2MEN1 | |
| SCHEMBL5229195 | 0.74 | POLB (0.40) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 | |
| SCHEMBL5907255 | 0.70 | CYP2A13 (0.42) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 | |
| SCHEMBL5224327 | 0.70 | KDM4E (0.36) | ALDH1A1LMNAUSP2SMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |