Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPT1B | Q92523 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 13/20 | 0.39 |
| ▸ | CES1 | P23141 | 12/20 | 0.39 |
| ▸ | PTPRC | P08575 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.39 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPRF | P10586 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10226600 | 0.86 | CES2 (0.60) | CES2CES1RAB9A | |
| SCHEMBL3644304 | 0.83 | TSHR (0.55) | CES2CES1 | |
| SCHEMBL17907433 | 0.80 | ALDH1A1 (0.48) | RAB9A | |
| SCHEMBL31256698 | 0.78 | MAPK1 (0.47) | RAB9A | |
| SCHEMBL8065192 | 0.78 | ALDH1A1 (0.56) | RAB9A | |
| SCHEMBL3640480 | 0.78 | RXRA (0.50) | — | |
| SCHEMBL3974617 | 0.77 | PARP10 (0.47) | — | |
| SCHEMBL8068752 | 0.77 | ALDH1A1 (0.45) | CES2CES1 | |
| SCHEMBL7611819 | 0.76 | CPT1B (0.78) | CPT1BCES2CES1PTPRCPTPN1 | |
| SCHEMBL2666587 | 0.74 | MAPT (0.45) | CES2CES1 |
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-2000053313-A2 | LANTHANIDE CATALYSTS FOR SYNTHESIS OF COMPOUNDS AND COMBINATORIAL LIBRARIES | ARQULE, INC. (US) | 2000-09-14 | — | — | WO | disclosed |