Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RORB | Q92753 | 7/20 | 0.44 |
| ▸ | RORC | P51449 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8606571 | 0.86 | TSHR (0.63) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL9712554 | 0.86 | CES2 (0.58) | CES2CES1ALDH1A1RECQLKMT2A | |
| Selenium SCHEMBL30382145 | 0.83 | CES2 (0.65) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL5285030 | 0.83 | ALDH1A1 (0.52) | CES2CES1ALDH1A1POLBTSHR | |
| SCHEMBL29399311 | 0.83 | CES2 (0.71) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL50416 | 0.83 | CES2 (0.71) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL93365 | 0.81 | TSHR (0.68) | CES2CES1ALDH1A1KMT2APOLB | |
| SCHEMBL3444846 | 0.81 | CES2 (0.68) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL93276 | 0.81 | CES2 (0.68) | CES2CES1ALDH1A1RECQLKMT2A | |
| SCHEMBL29368196 | 0.81 | CES2 (0.68) | CES2CES1ALDH1A1RECQLKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1609789-A1 | UREIDO-PYRAZOLE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-12-28 | — | — | EP | disclosed |