Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | TACR2 | P21452 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | VDR | P11473 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5524346 | 0.90 | TACR2 (0.39) | NR1H4PTGS2TACR2TACR1HTT | |
| SCHEMBL5514514 | 0.89 | PTGS2 (0.38) | NR1H4PTGS2TACR2TACR1SMN1; SMN2 | |
| SCHEMBL791555 | 0.83 | NR1H4 (0.41) | NR1H4PTGS2VDR | |
| SCHEMBL5519425 | 0.80 | TACR2 (0.38) | NR1H4TACR2TACR1SMN1; SMN2HPGD | |
| SCHEMBL5514105 | 0.79 | NR1H4 (0.47) | NR1H4PTGS2CNR1VDR | |
| SCHEMBL5508934 | 0.74 | MAPT (0.47) | NR1H4ALDH1A1NPSR1VDR | |
| SCHEMBL5527483 | 0.73 | NR1H4 (0.51) | NR1H4VDR | |
| Hydrochloric Acid SCHEMBL5512953 | 0.73 | NR1H4 (0.49) | NR1H4VDR | |
| Hydrochloric Acid SCHEMBL5515106 | 0.72 | NR1H4 (0.50) | NR1H4VDR | |
| SCHEMBL5509930 | 0.72 | RPS6KB1 (0.45) | NR1H4CNR1VDR |
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-1162196-A1 | FUSED-RING COMPOUNDS AND USE THEREOF AS DRUGS | JAPAN TOBACCO INC. (JP) | 2001-12-12 | — | — | EP | disclosed |