Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F11 | P03951 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.41 |
| ▸ | ACE | P12821 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19960667 | 0.94 | F11 (0.53) | F11HSD11B1ALDH1A1NPSR1DRD1 | |
| SCHEMBL19953516 | 0.94 | F11 (0.53) | F11HSD11B1ALDH1A1NPSR1DRD1 | |
| SCHEMBL19953491 | 0.81 | F11 (0.50) | F11HSD11B1ALDH1A1NPSR1DRD1 | |
| SCHEMBL19953658 | 0.81 | F11 (0.50) | F11HSD11B1ALDH1A1NPSR1DRD1 | |
| SCHEMBL19953529 | 0.79 | ACE (0.61) | F11ALDH1A1NPSR1TSHRMTNR1B | |
| SCHEMBL19953642 | 0.79 | ACE (0.61) | F11ALDH1A1NPSR1TSHRMTNR1B | |
| SCHEMBL19960681 | 0.77 | F11 (0.55) | F11HSD11B1ALDH1A1NPSR1DRD1 | |
| SCHEMBL3606637 | 0.77 | MEN1 (0.50) | DRD1MTNR1BACETRPV1 | |
| SCHEMBL5965344 | 0.76 | ACE (0.46) | F11NPSR1DRD1MTNR1BACE | |
| SCHEMBL19953782 | 0.76 | F11 (0.55) | F11ALDH1A1NPSR1TSHRMTNR1B |
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 |