Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 6/20 | 0.61 |
| ▸ | F11 | P03951 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 7/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19953642 | 1.00 | ACE (0.61) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19960681 | 0.87 | F11 (0.55) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL16111164 | 0.84 | ACE (0.68) | ACETSHRNPSR1KEAP1MTNR1B | |
| SCHEMBL19960667 | 0.83 | F11 (0.53) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19953516 | 0.83 | F11 (0.53) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19953782 | 0.80 | F11 (0.55) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19953658 | 0.80 | F11 (0.50) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19953491 | 0.80 | F11 (0.50) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL19953756 | 0.79 | F11 (0.48) | ACEF11TSHRALDH1A1NPSR1 | |
| SCHEMBL10901972 | 0.78 | ACE (0.60) | ACEKEAP1MTNR1B |
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 |