Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | IDE | P14735 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20042800 | 0.85 | CNR1 (0.45) | ALDH1A1TSHRHCRTR1HCRTR2CNR1 | |
| SCHEMBL20042806 | 0.82 | CNR1 (0.47) | ALDH1A1TSHRHCRTR1HCRTR2CNR1 | |
| SCHEMBL20042764 | 0.81 | CNR1 (0.49) | ALDH1A1TSHRHCRTR1HCRTR2CNR1 | |
| SCHEMBL20042979 | 0.79 | ALDH1A1 (0.42) | ALDH1A1CNR2IDH1 | |
| SCHEMBL20042816 | 0.77 | CNR1 (0.45) | ALDH1A1TSHRCNR2CNR1GPR55 | |
| SCHEMBL20042706 | 0.76 | ALDH1A1 (0.43) | ALDH1A1TSHRCNR2CNR1GPR55 | |
| SCHEMBL20042801 | 0.76 | CFTR (0.51) | TSHRKMT2AGRM5MEN1L3MBTL1 | |
| SCHEMBL20042814 | 0.76 | CFTR (0.52) | ALDH1A1TSHRKMT2AGBA1MEN1 | |
| SCHEMBL20042687 | 0.75 | HSD17B10 (0.51) | ALDH1A1KMT2AGBA1MEN1MAPT | |
| SCHEMBL31516224 | 0.75 | MTOR (0.46) | CNR2CNR1KMT2AGBA1MEN1 |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |