Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.39 |
| ▸ | CLPP | Q16740 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12366238 | 0.93 | DCTPP1 (0.42) | CFTRGLO1CNR1DCTPP1KDM4E | |
| SCHEMBL12366212 | 0.93 | CNR1 (0.44) | CFTRCNR1DCTPP1KDM4EHPGD | |
| SCHEMBL12366487 | 0.92 | CNR1 (0.39) | CFTRCNR1DCTPP1KDM4EHPGD | |
| SCHEMBL12366320 | 0.91 | KDM4E (0.47) | CNR1DCTPP1KDM4EHPGDNPSR1 | |
| SCHEMBL12366308 | 0.91 | RXRA (0.43) | CNR1DCTPP1KDM4EHPGDRXRA | |
| SCHEMBL12366313 | 0.90 | CNR1 (0.38) | CFTRCNR1DCTPP1CLPPKDM4E | |
| SCHEMBL12366359 | 0.90 | PKN1 (0.43) | CFTRCNR1DCTPP1CLPPKDM4E | |
| SCHEMBL12366245 | 0.90 | CNR1 (0.43) | CNR1DCTPP1KDM4EHPGDNPSR1 | |
| SCHEMBL12366226 | 0.89 | RGS4 (0.43) | CFTRCNR1RGS4RGS8 | |
| SCHEMBL12366278 | 0.89 | MAPT (0.45) | KDM4EFABP4PPARGCA12CA9 |
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-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |