Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.39 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CCNC | P24863 | 2/20 | 0.34 |
| ▸ | CDK8 | P49336 | 2/20 | 0.34 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31507488 | 0.82 | LMNA (0.42) | MAPK14MAP2K3GRM2LMNACCNC | |
| SCHEMBL26684723 | 0.82 | LMNA (0.42) | MAPK14MAP2K3GRM2LMNACCNC | |
| SCHEMBL3467324 | 0.75 | DHODH (0.41) | MAPK14MAP2K3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL30761194 | 0.70 | SIRT3 (0.47) | GRM2CCNCCDK8IKBKB | |
| SCHEMBL28205638 | 0.69 | MKNK1 (0.49) | MAPK14MAP2K3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5550504 | 0.68 | GSK3B (0.38) | CTSDBACE1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3112850 | 0.68 | LMNA (0.48) | GRM2LMNAPOLBCDK8IKBKB | |
| SCHEMBL28808945 | 0.67 | LMNA (0.47) | GRM2LMNAPOLBCDK8CYP1A2 | |
| Hydrochloric Acid SCHEMBL17048486 | 0.67 | LMNA (0.47) | GRM2LMNAPOLBCDK8IKBKB | |
| SCHEMBL19641722 | 0.67 | LMNA (0.47) | GRM2LMNAPOLBCDK8CYP1A2 |
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-2023217906-A1 | PYRROLIDINONE DERIVATIVES AS INHIBITORS OF NF KAPPA B INDUCING KINASE | JANSSEN PHARMACEUTICA NV (BE) | 2023-11-16 | — | — | WO | disclosed |