Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 4/20 | 0.52 |
| ▸ | CA12 | O43570 | 5/20 | 0.45 |
| ▸ | CA9 | Q16790 | 5/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
| ▸ | SORD | Q00796 | 1/20 | 0.44 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4075975 | 0.89 | ALOX5 (0.53) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL27771665 | 0.86 | CA12 (0.45) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL2985971 | 0.79 | CA12 (0.50) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL27792838 | 0.78 | ALOX5 (0.48) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL4077549 | 0.76 | CA12 (0.65) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL3018453 | 0.76 | CA12 (0.65) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL21648244 | 0.76 | CA12 (0.74) | CA12CA9MAOBALDH2AKR1B1 | |
| SCHEMBL761453 | 0.75 | CA9 (0.47) | ALOX5CA12CA9MAOBALDH2 | |
| SCHEMBL9009049 | 0.75 | CA9 (0.62) | CA12CA9MAOBALDH2AKR1B1 | |
| SCHEMBL9845372 | 0.74 | GABRP (0.58) | ALOX5CA12CA9MAOBALDH2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102627638-A | Thiadiazole substituted coumarin derivatives and their use as leukotriene biosynthesis inhibitor | MERCK FROSST CANADA LTD | 2012-08-08 | — | — | CN | disclosed |
| CN-101146802-A | Thiadiazole-substituted coumarin derivatives and their use as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA LTD (CA) | 2008-03-19 | — | — | CN | disclosed |