Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 6/20 | 0.42 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19960674 | 0.89 | PARP1 (0.41) | GRM7ALDH1A1TSHRSMN1; SMN2HTT | |
| SCHEMBL19960805 | 0.86 | GRM7 (0.39) | ACEGRM7ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL19960675 | 0.85 | PARP1 (0.38) | GRM7ALDH1A1TSHRSMN1; SMN2HTT | |
| SCHEMBL19953768 | 0.83 | TSHR (0.50) | GRM7ALDH1A1TSHRCYP2C9MAPT | |
| SCHEMBL19960826 | 0.82 | ACE (0.47) | ACEGRM7 | |
| SCHEMBL19953701 | 0.82 | ACE (0.47) | ACEGRM7 | |
| SCHEMBL19960658 | 0.81 | GRM7 (0.43) | ACEGRM7ALDH1A1 | |
| SCHEMBL20113077 | 0.81 | GRM7 (0.43) | ACEGRM7ALDH1A1 | |
| SCHEMBL19953523 | 0.81 | GRM7 (0.43) | ACEGRM7ALDH1A1 | |
| SCHEMBL19960407 | 0.80 | ACE (0.43) | ACEGRM7ALDH1A1LMNA |
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-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |