Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.39 |
| ▸ | KIF11 | P52732 | 3/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | ACP1 | P24666 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31013582 | 0.91 | AKR1C3 (0.44) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL31013592 | 0.85 | HSD17B2 (0.44) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL31013596 | 0.85 | HSD17B2 (0.44) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL1086771 | 0.84 | RAPGEF4 (0.50) | AKR1C3AKR1C2APPACP1MAPKAPK2 | |
| SCHEMBL10002566 | 0.84 | RAPGEF4 (0.44) | AKR1C3AKR1C2APPMAPKAPK2RAPGEF4 | |
| SCHEMBL24175562 | 0.83 | AKR1C3 (0.46) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL4629998 | 0.82 | AKR1C3 (0.36) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL6131645 | 0.81 | APP (0.48) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL4629995 | 0.81 | APP (0.48) | AKR1C3AKR1C2KIF11XDHSLC22A12 | |
| SCHEMBL30675131 | 0.80 | ALDH1A1 (0.50) | AKR1C3AKR1C2ACP1MAPKAPK2 |
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-6956095-B2 | Process for producing aryl—aryl coupled compounds | COVION ORGANIC SEMICONDUCTORS GMBH (DE) | 2005-10-18 | — | — | US | disclosed |