Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.50 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13409926 | 0.91 | PLK1 (0.53) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| SCHEMBL3682901 | 0.87 | CPT2 (0.53) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| SCHEMBL3682905 | 0.87 | CPT2 (0.53) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| SCHEMBL13409973 | 0.83 | PPARG (0.60) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| SCHEMBL14823051 | 0.78 | PLK1 (0.58) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| Trifluoroacetic Acid SCHEMBL3690939 | 0.78 | PPARG (0.53) | PLK1PPARGPPARATSHR | |
| Trifluoroacetic Acid SCHEMBL3690941 | 0.76 | PPARG (0.52) | PLK1PPARGPPARATSHR | |
| Trifluoroacetic Acid SCHEMBL3690945 | 0.76 | PPARG (0.52) | PLK1PPARGPPARATSHR | |
| SCHEMBL3690943 | 0.74 | PPARG (0.49) | PLK1TAS1R3TAS1R1PPARGPPARA | |
| SCHEMBL19781326 | 0.71 | PPARG (0.83) | PLK1TAS1R3TAS1R1PPARGPPARA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008109991-A1 | INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER | UNIVERSITY HEALTH NETWORK (CA) | 2008-09-18 | — | — | WO | disclosed |