Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PPIA | P62937 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2087007 | 0.89 | HTT (0.57) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL6612663 | 0.85 | ALDH1A1 (0.68) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL6585917 | 0.84 | ALDH1A1 (0.55) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL4611494 | 0.84 | HTT (0.64) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL6605329 | 0.83 | HTT (0.60) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL28137220 | 0.83 | HTT (0.65) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL8567716 | 0.82 | HTT (0.62) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL2087895 | 0.81 | HTT (0.57) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL1523101 | 0.81 | HTT (0.57) | HTTALDH1A1KDM4EHSD17B10HPGD | |
| SCHEMBL1522683 | 0.80 | MAPT (0.62) | HTTALDH1A1KDM4EHSD17B10HPGD |
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-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |