Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | GLP1R | P43220 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL3061412 | 0.88 | RPS6KA5 (0.48) | RAB9AKMT2ANPC1RPS6KA5GRM2 | |
| SCHEMBL3068284 | 0.86 | RAB9A (0.39) | TSHRRAB9AKMT2ATP53NPC1 | |
| SCHEMBL3055367 | 0.80 | RPS6KA5 (0.40) | RAB9AKMT2ANPC1RPS6KA5GRM2 | |
| SCHEMBL3064975 | 0.78 | BRD4 (0.39) | KMT2ATP53RPS6KA5GRM2BRD4 | |
| SCHEMBL3060221 | 0.76 | CYP11B1 (0.38) | RAB9AKMT2ANPC1RPS6KA5GRM2 | |
| SCHEMBL3062897 | 0.75 | PKM (0.36) | GRM2BRD4CYP1A2CYP2C19LMNA | |
| SCHEMBL3068770 | 0.75 | RPS6KA5 (0.45) | RAB9AKMT2ANPC1RPS6KA5GRM2 | |
| SCHEMBL3060407 | 0.75 | RPS6KA5 (0.37) | RAB9AKMT2ATP53NPC1RPS6KA5 | |
| SCHEMBL3060473 | 0.74 | PKM (0.41) | TSHRRAB9ANPC1RPS6KA5BRD4 | |
| SCHEMBL3066024 | 0.74 | RPS6KA5 (0.41) | RAB9AKMT2ARPS6KA5HSD17B10HPGD |
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-1368342-B3 | BENZIMIDAZOLE AND PYRIDYLIMIDAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | NEUROGEN CORP (US) | 2010-12-01 | — | — | EP | disclosed |