Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 3/20 | 0.46 |
| ▸ | SCD | O00767 | 2/20 | 0.44 |
| ▸ | CDK4 | P11802 | 1/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | CCND3 | P30281 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | HPSE | Q9Y251 | 3/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 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 | |
|---|---|---|---|---|
| SCHEMBL11020063 | 0.93 | CHEK2 (0.56) | CHEK2SCDCDK4CCNA2CCND1 | |
| SCHEMBL11018765 | 0.91 | SCD (0.41) | CHEK2SCDCYP2B6HDAC6CHRNB2 | |
| SCHEMBL11019245 | 0.90 | CHEK2 (0.44) | CHEK2SCDPDE2A | |
| SCHEMBL11036642 | 0.89 | PDE2A (0.41) | CHEK2SCDCYP2B6HDAC6CHRNB2 | |
| SCHEMBL11020236 | 0.89 | CHEK2 (0.48) | CHEK2PDE2A | |
| SCHEMBL11020909 | 0.85 | PDE7A (0.41) | SCDPDE7AHPSEPDE2ACOMT | |
| SCHEMBL11018034 | 0.83 | RHEB (0.39) | CHEK2SCDHPSE | |
| SCHEMBL11018770 | 0.83 | KDM4E (0.47) | CHEK2SCDHDAC6 | |
| SCHEMBL11019250 | 0.82 | CHEK2 (0.53) | CHEK2HDAC6 | |
| SCHEMBL11018830 | 0.81 | PDE2A (0.44) | PDE7AHPSEPDE2ACYP1A2 |
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-0148431-A1 | Benzimidazoles, their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1985-07-17 | — | — | EP | disclosed |