Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.53 |
| ▸ | PPARD | Q03181 | 1/20 | 0.53 |
| ▸ | PPARA | Q07869 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22792702 | 0.87 | KDM4E (0.47) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL12968838 | 0.83 | ADRB1 (0.68) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL9725103 | 0.83 | ADRB1 (0.59) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL18176129 | 0.81 | ADRB1 (0.73) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL20013708 | 0.81 | ADRB1 (0.57) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL24008459 | 0.80 | ADRB1 (0.71) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL13018936 | 0.79 | HRH3 (0.65) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL15345047 | 0.78 | DRD4 (0.50) | ALDH1A1HRH3DRD2DRD3 | |
| SCHEMBL1901605 | 0.78 | ADRB1 (0.69) | ADRB1KDM4ECYP2D6L3MBTL1PPARG | |
| SCHEMBL1998032 | 0.78 | ADRB1 (0.69) | ADRB1KDM4ECYP2D6L3MBTL1PPARG |
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 |
|---|---|---|---|---|---|---|---|
| EP-1296954-A1 | BICYCLIC LACTAMS AND SULFONAMIDES WITH 5-HT1A-AFFINITY AND USE THEREOF FOR PREVENTING AND TREATING CEREBRAL ISCHAEMIA | Abbott GmbH & Co. KG (DE) | 2003-04-02 | — | — | EP | disclosed |
| WO-2002002529-A1 | BICYCLIC LACTAMS AND SULFONAMIDES WITH 5-HT1A-AFFINITY AND USE THEREOF FOR PREVENTING AND TREATING CEREBRAL ISCHAEMIA | ABBOTT GMBH & CO. KG (DE) | 2002-01-10 | — | — | WO | disclosed |