Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 2/20 | 0.39 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10656806 | 0.83 | NPSR1 (0.42) | CYP2A6PDE9APRKCZGRIA4MAPT | |
| SCHEMBL10655134 | 0.82 | KDM4E (0.43) | PRKCZGRIA4MAPTMEN1KMT2A | |
| SCHEMBL10651575 | 0.82 | PDCD1 (0.46) | PDCD1CD274PRKCZGRIA4MAPT | |
| SCHEMBL10655060 | 0.81 | GRIA4 (0.47) | GRIA4MAPTMEN1KMT2AHPGD | |
| SCHEMBL10656103 | 0.79 | ALDH1A1 (0.52) | PRKCZMAPTMEN1KMT2AHPGD | |
| SCHEMBL10653315 | 0.78 | KIF11 (0.42) | PDCD1CD274PRKCZGRIA4MAPT | |
| SCHEMBL10651211 | 0.75 | MAPK14 (0.40) | PRKCZMAPTALDH1A1ALOX15HSD17B10 | |
| SCHEMBL10656232 | 0.72 | ALOX5 (0.40) | PRKCZGRIA4MAPTMEN1KMT2A | |
| SCHEMBL10653113 | 0.71 | ALDH1A1 (0.41) | PRKCZGRIA4MAPTMEN1KMT2A | |
| SCHEMBL10653878 | 0.71 | ADORA1 (0.43) | PRKCZGRIA4MAPTMEN1KMT2A |
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-0273602-A1 | 3-Cyano-4-arylthiophenes | ELI LILLY AND COMPANY (US) | 1988-07-06 | — | — | EP | disclosed |