Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.83 |
| ▸ | ABCC1 | P33527 | 4/20 | 0.83 |
| ▸ | ABCC2 | Q92887 | 3/20 | 0.83 |
| ▸ | MEN1 | O00255 | 1/20 | 0.83 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.83 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.83 |
| ▸ | ABCC5 | O15440 | 1/20 | 0.83 |
| ▸ | SLCO2B1 | O94956 | 1/20 | 0.83 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.83 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.83 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.83 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.83 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.83 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.82 |
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 | |
|---|---|---|---|---|
| SCHEMBL9258247 | 1.00 | CYSLTR1 (0.83) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| SCHEMBL9260443 | 0.94 | CYSLTR1 (0.79) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| SCHEMBL9260450 | 0.94 | CYSLTR1 (0.79) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| SCHEMBL17833480 | 0.92 | CYSLTR1 (0.89) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| Verlukast SCHEMBL2729252 | 0.91 | CYSLTR1 (1.00) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| Verlukast SCHEMBL37246 | 0.91 | CYSLTR1 (1.00) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| Mk-571 SCHEMBL9231584 | 0.91 | CYSLTR1 (1.00) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| Mk-571 SCHEMBL30509651 | 0.91 | CYSLTR1 (1.00) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| Verlukast SCHEMBL37247 | 0.91 | CYSLTR1 (1.00) | CYSLTR1ABCC1ABCC2MEN1ABCC3 | |
| SCHEMBL9327842 | 0.90 | CYSLTR1 (0.73) | CYSLTR1ABCC1ABCC2MEN1ABCC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0328188-A2 | Process for unsymmetrical dithioacetals and dithioketals | MERCK & CO. INC. (US) | 1989-08-16 | — | — | EP | claimed |
| US-5428171-A | Leukotrienes antagonist; antiasthmatic, antiallergic, anti-inflammatory and cytoprotective agent | MERCK FROSST CANADA, INC. (CA) | 1995-06-27 | — | — | US | disclosed |
| US-5136034-A | Reacting an arylaldehyde with mercaptan and thioacyl in presence of acid catalysts; then reacting with electrophile | MERCK FROSST CANADA, INC. (CA) | 1992-08-04 | — | — | US | disclosed |
| US-4883878-A | REACTION OF QUINOLINE ALDEHYDE WITH AMIDE OR ESTER SUBSTITUTED MERCAPTAN | MERCK & CO. INC. (US) | 1989-11-28 | — | — | US | disclosed |
| EP-0328188-A2 | Process for unsymmetrical dithioacetals and dithioketals | MERCK & CO. INC. (US) | 1989-08-16 | — | — | EP | disclosed |
| US-4851409-A | LEUKOTRIENE ANTAGONIST, ANTIASTHMA, ANTIALLERGEN, ANTIINFLAMMATORY, CYTOPROTECTIVE | MERCK FROSST CANADA INC. (CA) | 1989-07-25 | — | — | US | disclosed |