Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.69 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.66 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.58 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.58 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.58 |
| ▸ | APP | P05067 | 1/20 | 0.58 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | BCHE | P06276 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL5238958 | 0.94 | LTA4H (0.66) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL30539400 | 0.91 | LTA4H (0.68) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL15923575 | 0.89 | LTA4H (0.66) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL27974031 | 0.89 | LTA4H (0.66) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL36192 | 0.88 | LTA4H (0.87) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL1331014 | 0.88 | LTA4H (0.87) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| Benzene SCHEMBL28132981 | 0.88 | LTA4H (0.87) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL8972203 | 0.87 | LTA4H (0.58) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 | |
| Tetradecane SCHEMBL28375680 | 0.86 | SLC6A2 (0.57) | LTA4HAPPLMNACYP1A2PTGS1 | |
| SCHEMBL4057023 | 0.86 | CHRNA7 (0.65) | LTA4HCHRNA7CHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1453797-A1 | PROCESS FOR THE PREPARATION OF AN ENANTIOMERICALLY ENRICHED THIO COMPOUND | DSM IP Assets B.V. (NL) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003051827-A1 | PROCESS FOR THE PREPARATION OF AN ENANTIOMERICALLY ENRICHED THIO COMPOUND | DSM IP ASSETS B.V. (NL) | 2003-06-26 | — | — | WO | disclosed |