Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.42 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CETP | P11597 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200862 | 0.93 | CTSK (0.48) | TSPOBCHEACHECTSKHSD17B2 | |
| SCHEMBL14200773 | 0.91 | TSPO (0.44) | TSPOBCHEACHEHSD17B2MEP1B | |
| SCHEMBL14200860 | 0.90 | TSPO (0.42) | TSPOBCHEACHECTSKTAS1R3 | |
| SCHEMBL14228968 | 0.87 | TSPO (0.47) | TSPOBCHEACHETAS1R3TAS1R1 | |
| SCHEMBL14200833 | 0.85 | EPHX2 (0.45) | TSPOBCHEACHECTSKHSD17B2 | |
| SCHEMBL14200838 | 0.85 | ALDH1A1 (0.45) | TSPOBCHEACHEHSD17B2MEP1B | |
| SCHEMBL14200932 | 0.84 | HPGD (0.40) | ACHETAS1R3TAS1R1MEN1KMT2A | |
| SCHEMBL14200831 | 0.82 | LDHA (0.43) | ACHEMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL14200957 | 0.81 | POLB (0.43) | MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL14229220 | 0.80 | BCHE (0.48) | TSPOBCHEACHECTSKHSD17B2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |