Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 2/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.38 |
| ▸ | HNF4A | P41235 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23480907 | 0.86 | SLC22A12 (0.46) | CDK2XDHSLC22A12HTTPTGDR2 | |
| SCHEMBL18398646 | 0.84 | GSK3B (0.43) | CDK2XDHSLC22A12HTTPTGDR2 | |
| SCHEMBL13291209 | 0.80 | ALB (0.41) | CDK2XDHSLC22A12HTTMAP2K1 | |
| SCHEMBL27752918 | 0.79 | GABRP (0.44) | CDK2XDHSLC22A12NOTUMFFAR1 | |
| SCHEMBL3157619 | 0.79 | XDH (0.53) | XDHSLC22A12HTTMAP2K1PIN1 | |
| SCHEMBL13608787 | 0.77 | CA2 (0.41) | PTGDR2NOTUM | |
| SCHEMBL7196160 | 0.76 | XDH (0.46) | XDHSLC22A12HTTMAP2K1PIN1 | |
| SCHEMBL30902488 | 0.76 | HNF4A (0.62) | XDHSLC22A12HTTHNF4AMCL1 | |
| SCHEMBL131551 | 0.76 | HNF4A (0.62) | XDHSLC22A12HTTHNF4AMCL1 | |
| SCHEMBL1232210 | 0.76 | MEN1 (0.47) | HTTPTGDR2ALBGSK3B |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102596921-B | Novel compounds | GLAXO GROUP LTD | 2015-04-29 | — | — | CN | disclosed |
| CN-104292154-A | Novel compounds | GLAXO GROUP LTD | 2015-01-21 | — | — | CN | disclosed |
| CN-103221047-B | Compounds and methods | TEMPERO PHARMACEUTICALS INC | 2014-12-17 | — | — | CN | disclosed |
| CN-101970420-B | Oxadiazole derivatives | MERCK SERONO SA | 2014-09-24 | — | — | CN | disclosed |
| CN-102272111-A | 1,2 -thiazol yl derivatives as cannabinoid receptor ligands | — | 2011-12-07 | — | — | CN | disclosed |
| CN-101970420-A | Oxadiazole derivatives | MERCK SERONO SA | 2011-02-09 | — | — | CN | disclosed |
| CN-101765594-A | 1,3-thiazoles-2 (3H)-ylidene compounds as cannabinoid receptor ligand | ABBOTT LAB | 2010-06-30 | — | — | CN | disclosed |
| CN-101765593-A | 2-iminoisothiazole derivatives as cannabinoid receptor ligands | ABBOTT LAB | 2010-06-30 | — | — | CN | disclosed |
| EP-1362856-B1 | WATER-SOLUBLE TRIAZOLE FUNGICIDE | DAIICHI SANKYO CO LTD (JP) | 2008-09-10 | — | — | EP | disclosed |
| CN-1144805-C | Bispidine compounds useful in treatment of cardiac arrhythmias | — | 2004-04-07 | — | — | CN | disclosed |
| CN-1284956-A | Novel bispidine antiarrhythmic compounds | ASTRA ZENECA AKTIEBOLAG (SE) | 2001-02-21 | — | — | CN | disclosed |