Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6677507 | 0.92 | ALDH1A1 (0.34) | ALDH1A1PTGESLMNAPOLBCACNA1C | |
| SCHEMBL7247902 | 0.82 | NQO2 (0.46) | ALDH1A1LMNAPOLBTSHR | |
| SCHEMBL7247906 | 0.80 | LMNA (0.34) | ALDH1A1LMNAPOLBGLSCACNA1C | |
| SCHEMBL6680738 | 0.79 | NR1H4 (0.33) | ALDH1A1PTGESLMNAPOLBGLS | |
| SCHEMBL6675865 | 0.78 | KCNA5 (0.36) | LMNAPOLBGLSCACNA1CSCN5A | |
| SCHEMBL6679753 | 0.77 | LMNA (0.36) | ALDH1A1LMNAPOLBGLSHTT | |
| SCHEMBL6676767 | 0.74 | CACNA1C (0.43) | ALDH1A1LMNAPOLBCACNA1CSCN5A | |
| SCHEMBL6677282 | 0.72 | POLB (0.34) | ALDH1A1LMNAPOLBCACNA1CSCN5A | |
| SCHEMBL6675974 | 0.72 | CA1 (0.36) | ALDH1A1LMNAHTTNR1H4MCHR1 | |
| SCHEMBL6678215 | 0.72 | PTGES (0.41) | PTGESCTSLCTSBCTSSNR1H4 |
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-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | disclosed |