Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 4/20 | 0.47 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | LTK | P29376 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7015191 | 0.99 | CYP11B2 (0.46) | CYP11B2ACSS2CYP11B1BRD4DAPK3 | |
| SCHEMBL3061472 | 0.89 | ALOX5AP (0.43) | MEN1KMT2AALOX5AP | |
| Hydrochloric Acid SCHEMBL3063212 | 0.88 | ALOX5AP (0.42) | MEN1KMT2AALOX5AP | |
| SCHEMBL6218225 | 0.86 | TSHR (0.47) | CYP11B2ACSS2CYP11B1BRD4DAPK3 | |
| SCHEMBL1161796 | 0.83 | PPARG (0.46) | CYP11B2ACSS2CYP11B1BRD4DAPK3 | |
| SCHEMBL1638406 | 0.82 | ACSS2 (0.43) | CYP11B2ACSS2CYP11B1BRD4LMNA | |
| SCHEMBL1638450 | 0.80 | MAPT (0.47) | CYP11B2ACSS2CYP11B1BRD4LMNA | |
| SCHEMBL1638650 | 0.80 | ACSS2 (0.42) | CYP11B2ACSS2CYP11B1BRD4LMNA | |
| SCHEMBL7447330 | 0.79 | AGTR1 (0.48) | CYP11B2CYP11B1BRD4MEN1KMT2A | |
| SCHEMBL1636416 | 0.78 | ACSS2 (0.40) | CYP11B2ACSS2CYP11B1BRD4LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1368342-A2 | BENZIMIDAZOLE AND PYRIDYLIMIDAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | NEUROGEN CORPORATION (US) | 2003-12-10 | — | — | EP | disclosed |
| WO-2002050062-A2 | BENZIMIDAZOLE AND PYRIDYLIMIDAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | NEUROGEN CORPORATION (US) | 2002-06-27 | — | — | WO | disclosed |