Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 3/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.41 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.41 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL528444 | 0.86 | BCAT2 (0.55) | BCAT2KEAP1NFE2L2PARP1FGFR1 | |
| SCHEMBL72113 | 0.86 | PARP1 (0.49) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| SCHEMBL4065283 | 0.85 | MYC (0.47) | BCAT2KEAP1NFE2L2PARP1FGFR1 | |
| Charcoal, Activated SCHEMBL9345241 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| Hydrochloric Acid SCHEMBL7467552 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| SCHEMBL6321332 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| Fluoride SCHEMBL28693457 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| Hydrochloric Acid SCHEMBL8527465 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1MAPT | |
| SCHEMBL5524497 | 0.84 | PARP1 (0.47) | BCAT2KEAP1NFE2L2PARP1FGFR1 | |
| SCHEMBL4439618 | 0.83 | BCAT2 (0.62) | BCAT2KEAP1NFE2L2PARP1FGFR1 |
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-2121621-A1 | LXR AND FXR MODULATORS | Exelixis, Inc. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008073825-A1 | LXR AND FXR MODULATORS | EXELIXIS, INC. (US) | 2008-06-19 | — | — | WO | disclosed |