Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | RHEB | Q15382 | 1/20 | 0.40 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | QPCT | Q16769 | 1/20 | 0.39 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.39 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28292522 | 0.87 | QPCT (0.53) | MAP4K4RIPK1SCN10AQPCTQPCTL | |
| SCHEMBL10720 | 0.86 | IMPDH2 (0.47) | IMPDH2IMPDH1CHEK1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL3671410 | 0.84 | IMPDH2 (0.46) | IMPDH2IMPDH1CHEK1KDM4EALDH1A1 | |
| SCHEMBL6008269 | 0.84 | MAPT (0.50) | QPCTQPCTLKDM4EALDH1A1MAPT | |
| SCHEMBL31143361 | 0.84 | MAPT (0.50) | QPCTQPCTLKDM4EALDH1A1MAPT | |
| SCHEMBL14669435 | 0.80 | RHEB (0.51) | GSK3BRHEBDGAT1SOAT1KCNH2 | |
| SCHEMBL14669436 | 0.80 | RHEB (0.51) | GSK3BRHEBDGAT1SOAT1KCNH2 | |
| SCHEMBL27601236 | 0.79 | QPCT (0.41) | QPCTQPCTLKDM4EALDH1A1MAPT | |
| SCHEMBL2457365 | 0.79 | QPCT (0.50) | CDK5CDK5R1GSK3BQPCTQPCTL | |
| SCHEMBL13373486 | 0.77 | PARP1 (0.46) | QPCTQPCTLCHEK1KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106866543-B | A method of benzimidazole compound is catalyzed and synthesized under microwave radiation in water phase | 福建医科大学 | 2019-05-14 | — | — | CN | disclosed |