Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.34 |
| ▸ | RHEB | Q15382 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL91729 | 0.86 | ERN1 (0.32) | MAPTFFAR4PTPN1 | |
| SCHEMBL91700 | 0.82 | S1PR1 (0.43) | ARS1PR1NOTUMRAPGEF4CTSS | |
| SCHEMBL91730 | 0.79 | ESR1 (0.32) | PTPN1 | |
| SCHEMBL91721 | 0.79 | S1PR1 (0.38) | ARS1PR1NOTUMCTSSCTSK | |
| SCHEMBL91877 | 0.78 | PTGDR2 (0.32) | — | |
| SCHEMBL91720 | 0.76 | KMT2A (0.39) | ARRHEBNOTUMCETPMAPT | |
| SCHEMBL91808 | 0.76 | AR (0.31) | AR | |
| SCHEMBL91828 | 0.71 | — | — | |
| SCHEMBL91836 | 0.71 | GPR3 (0.37) | ARS1PR1NOTUMHSD11B1 | |
| SCHEMBL91753 | 0.71 | — | — |
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-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |