Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 2/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL24964824 | 0.84 | LMNA (0.54) | LMNAPOLBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24964991 | 0.77 | CES2 (0.48) | LMNAPOLBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24963385 | 0.74 | LMNA (0.43) | LMNAPOLBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24963420 | 0.72 | LMNA (0.41) | LMNAPOLBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1219593 | 0.69 | LMNA (0.95) | LMNACYP2C19ALDH1A1HPGD | |
| SCHEMBL8296748 | 0.69 | LMNA (0.54) | LMNAPOLBPTGS1CES2CES1 | |
| SCHEMBL24963538 | 0.69 | CCR9 (0.38) | LMNAPOLBIDO1CES2CES1 | |
| SCHEMBL24962589 | 0.69 | PROKR1 (0.39) | LMNAPOLB | |
| Acetic Acid SCHEMBL9162827 | 0.68 | LMNA (0.72) | LMNACYP1A2CYP2C9CYP2C19CES2 | |
| Hydrochloric Acid SCHEMBL1033555 | 0.68 | LMNA (1.00) | LMNACYP2C19IDO1ALDH1A1HPGD |
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-2023004280-A1 | SELECTIVE PYRAZOLE LRRK2 INHIBITORS AND METHODS FOR USE THEREOF | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2023-01-26 | — | — | WO | disclosed |