Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | TACR2 | P21452 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10812999 | 0.79 | CYP2A6 (0.48) | PTGS2CYP2A6ALDH1A1MAPTHPGD | |
| SCHEMBL10888784 | 0.78 | HSD17B10 (0.43) | HSD17B10PTGS2CYP1A2MAOBAHR | |
| SCHEMBL10487688 | 0.78 | HSD17B10 (0.43) | HSD17B10MAOBAHRLMNACYP2A6 | |
| SCHEMBL12016063 | 0.78 | NFE2L2 (0.44) | PTGS2CYP1A2MAOBAHRMAOA | |
| SCHEMBL8988570 | 0.77 | ALDH5A1 (0.46) | HSD17B10PTGS2CYP1A2MAOBLMNA | |
| SCHEMBL16958674 | 0.77 | AHR (0.42) | CYP1A2AHRMAPTL3MBTL1 | |
| SCHEMBL16961107 | 0.77 | TRPA1 (0.43) | ALDH1A1MAPTTRPA1 | |
| SCHEMBL2580643 | 0.76 | AKT1 (0.42) | CYP1A2MAOBLMNACYP2A6ALDH1A1 | |
| SCHEMBL1609713 | 0.75 | HSD17B10 (0.55) | HSD17B10PTGS2CYP1A2MAOBAHR | |
| SCHEMBL10887511 | 0.75 | CYP1A2 (0.48) | HSD17B10PTGS2CYP1A2LMNAALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6844347-B1 | Cyclic guanosine monophosphate modulators; cardiovascular diseases; guanylate cyclase activation | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2005-01-18 | — | — | US | disclosed |