Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.34 |
| ▸ | BAX | Q07812 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL7954828 | 0.80 | LTA4H (0.41) | LTA4HTSHRCA5ACA5BCA4 | |
| SCHEMBL2522708 | 0.80 | LTA4H (0.41) | LTA4HTSHRCA5ACA5BCA4 | |
| SCHEMBL10626679 | 0.77 | ACHE (0.41) | TSHRALDH1A1L3MBTL1MEN1MAPT | |
| SCHEMBL6552309 | 0.77 | MAOB (0.39) | ALDH1A1RECQLATMMEN1KMT2A | |
| SCHEMBL8104753 | 0.77 | LTA4H (0.35) | LTA4HTSHRCA5ACA5BCA4 | |
| SCHEMBL4010662 | 0.76 | ALDH1A1 (0.43) | LTA4HTSHRCA5ACA5BALDH1A1 | |
| SCHEMBL19247 | 0.75 | LTA4H (0.41) | LTA4HTSHRCA5ACA5BCA4 | |
| Potassium Ion SCHEMBL28444151 | 0.74 | CA12 (0.47) | LTA4HTSHRCA5ACA5BCA4 | |
| SCHEMBL10628533 | 0.73 | IDO1 (0.45) | ALDH1A1 | |
| SCHEMBL10653814 | 0.73 | CYP1A1 (0.39) | ALDH1A1MEN1MAPTKMT2ALMNA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5310759-A | — | — | None | — | — | JP | disclosed |
| JP-H05310759-A | INTERMEDIATE FOR PREPARATION OF 2-ALKYLTHIOPEN-2-EM-3-CARBOXYLIC ACID ANTIBIOTIC | MERCK & CO INC | 1993-11-22 | — | — | JP | disclosed |
| EP-0320497-A1 | Substituted 2-thioxopenams, intermediates therefrom and process for preparing substituted 2-thioxopenams and 2-substituted thiopenems | MERCK & CO. INC. (US) | 1989-06-14 | — | — | EP | disclosed |
| US-4675317-A | PENICILLIN ANTIBIOTICS | MERCK & CO., INC. (US) | 1987-06-23 | — | — | US | disclosed |
| US-4610823-A | INTERMEDIATES FOR PENEM ANTIBIOTICS | MERCK & CO., INC. (US) | 1986-09-09 | — | — | US | disclosed |
| EP-0115308-A2 | 2-Unsaturated alkylthio-pen-2-em-3-carboxylic acids and process for preparing substituted 2-thioxopenams and 2-substituted thiopenems | MERCK & CO. INC. (US) | 1984-08-08 | — | — | EP | disclosed |