Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1031907 | 0.95 | HTT (0.55) | TSHRALDH1A1HTTLMNAMAPK1 | |
| SCHEMBL1031140 | 0.86 | NPSR1 (0.49) | TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL1030647 | 0.83 | HTT (0.59) | TSHRALDH1A1HTTLMNAMAPK1 | |
| SCHEMBL1033858 | 0.78 | NR1I3 (0.42) | SMN1; SMN2 | |
| SCHEMBL1032186 | 0.77 | ALDH1A1 (0.46) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL1031916 | 0.77 | NPSR1 (0.51) | TSHRHTTLMNAMAPK1 | |
| SCHEMBL1032118 | 0.76 | POLB (0.40) | ALDH1A1HTTLMNAMAPK1SMN1; SMN2 | |
| SCHEMBL1031782 | 0.74 | CYP3A4 (0.45) | ALDH1A1HTTLMNASMN1; SMN2 | |
| SCHEMBL2637874 | 0.74 | PKM (0.47) | — | |
| SCHEMBL1028958 | 0.74 | SIGMAR1 (0.44) | ALDH1A1HTTLMNASMN1; 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-2035375-B1 | 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2011-01-19 | — | — | EP | claimed |