Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 1/20 | 0.58 |
| ▸ | GABRD | O14764 | 1/20 | 0.58 |
| ▸ | TNKS | O95271 | 1/20 | 0.58 |
| ▸ | PARP1 | P09874 | 1/20 | 0.58 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.58 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.58 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.58 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.58 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.58 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.58 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.58 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.58 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.58 |
| ▸ | GABRE | P78334 | 1/20 | 0.58 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.58 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.58 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.58 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.58 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 6/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29182638 | 0.86 | CA9 (0.64) | GABRPGABRDTNKSPARP1GABRA1 | |
| SCHEMBL516275 | 0.86 | CA9 (0.68) | GABRPGABRDTNKSPARP1GABRA1 | |
| SCHEMBL31264770 | 0.86 | CA9 (0.68) | GABRPGABRDTNKSPARP1GABRA1 | |
| SCHEMBL28360775 | 0.84 | HSD11B1 (0.50) | GABRPGABRDTNKSPARP1GABRA1 | |
| SCHEMBL1181618 | 0.83 | CA12 (0.69) | TNKSCA12CA9AKR1B1MAOB | |
| SCHEMBL10603540 | 0.82 | AKR1B1 (0.60) | GABRPGABRDTNKSGABRA1GABRB1 | |
| SCHEMBL5396825 | 0.82 | NQO1 (0.67) | CA12CA9AKR1B1MAOBALDH2 | |
| SCHEMBL29182639 | 0.81 | CA9 (0.54) | CA12CA9AKR1B1MAOBALDH2 | |
| SCHEMBL4077549 | 0.80 | CA12 (0.65) | CA12CA9AKR1B1MAOBALDH2 | |
| SCHEMBL13236780 | 0.80 | NOD2 (0.68) | TNKSMAOBCA1CYP1A2RECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1802372-B | 7-[(1,3-thiazol-2-yl)thio]-coumarin derivatives and their use as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA LTD | 2010-05-12 | — | — | CN | disclosed |
| CN-1802372-A | 7-[(1,3-thiazol-2-yl)thio]-coumarin derivatives and their use as leukotriene biosynthesis inhibitors | MERCK FROSST CANADA LTD (CA) | 2006-07-12 | — | — | CN | disclosed |
| EP-0420266-A2 | Chromene or thiochromene derivatives, process for preparing the same, intermediate therefor, pharmaceutical compositions containing said derivatives and the use of said derivatives | TANABE SEIYAKU CO., LTD. (JP) | 1991-04-03 | — | — | EP | disclosed |