Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CTSC | P53634 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL6453628 | 0.79 | HSD17B2 (0.42) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL3936768 | 0.77 | ALOX5 (0.40) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL3936766 | 0.77 | ALOX5 (0.40) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL5848158 | 0.77 | ALOX5 (0.40) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL3898505 | 0.75 | CACNA2D1 (0.47) | ALOX5HSD17B2TP53POLB | |
| SCHEMBL3898507 | 0.75 | CACNA2D1 (0.47) | ALOX5HSD17B2TP53POLB | |
| SCHEMBL14033294 | 0.74 | ALOX5 (0.45) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL5914989 | 0.73 | CACNA2D1 (0.38) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL5915001 | 0.73 | CACNA2D1 (0.38) | ALOX5HSD17B2CES2CES1KEAP1 | |
| SCHEMBL5915051 | 0.73 | CACNA2D1 (0.38) | ALOX5HSD17B2CES2CES1KEAP1 |
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-2009019719-A2 | PROCESS FOR THE PREPARATION OF 3-ARYLOXY-3-ARYLPROPANAMINES | IND-SWIFT LABORATORIES LIMITED (IN) | 2009-02-12 | — | — | WO | disclosed |