Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL5229173 | 0.91 | DRD4 (0.47) | SMOKDM4EMAPTALDH1A1LMNA | |
| SCHEMBL1998311 | 0.83 | SMO (0.60) | SMOMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL5224506 | 0.82 | ALDH1A1 (0.51) | KDM4EMAPTALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL2761237 | 0.78 | SMO (0.43) | SMOKDM4EMAPTALDH1A1LMNA | |
| SCHEMBL5227445 | 0.77 | DRD4 (0.46) | SMOMAPTALDH1A1GAAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL1997589 | 0.77 | SMO (0.42) | SMOKDM4EMAPTALDH1A1LMNA | |
| SCHEMBL5224916 | 0.75 | SMO (0.44) | SMOMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL1997979 | 0.74 | SMO (0.60) | SMOMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL5223624 | 0.74 | SMO (0.41) | SMOMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL5224322 | 0.74 | ALDH1A1 (0.51) | KDM4EMAPTALDH1A1LMNASMN1; SMN2 |
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 |