Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ESRRB | O95718 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11715619 | 0.93 | ALDH1A1 (0.51) | BCHEACHEALDH1A1KDM4EHRH3 | |
| SCHEMBL11719155 | 0.92 | KDM4E (0.52) | BCHEACHEALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL11714292 | 0.88 | ESR1 (0.54) | ESR1MAPTALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL6057420 | 0.87 | ESR1 (0.59) | ESR1BCHEACHEKEAP1NFE2L2 | |
| SCHEMBL11716908 | 0.86 | SIGMAR1 (0.56) | ESR1BCHEACHEHRH3DRD3 | |
| SCHEMBL11722280 | 0.85 | ESR1 (0.53) | ESR1NPC1RAB9AUSP2SMN1; SMN2 | |
| SCHEMBL11715756 | 0.85 | BCHE (0.51) | BCHEACHEHRH3NPC1RAB9A | |
| SCHEMBL11719732 | 0.83 | THRA (0.54) | BCHEACHEHRH3DRD3GAA | |
| SCHEMBL11717604 | 0.83 | BCHE (0.59) | BCHEACHEHRH3CYP2D6CYP1A2 | |
| SCHEMBL11720107 | 0.82 | ESR1 (0.46) | ESR1BCHEACHEHRH3NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4010272-A | ANTHELMINTICALLY ACTIVE BASICALLY SUBSTITUTED 2-CARBALKOXY-AMINO-BENZIMIDAZOLYL-5(6)-PHENYL ETHERS AND -KETONES | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-03-01 | — | — | US | disclosed |