Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA5 | P22460 | 1/20 | 0.50 |
| ▸ | KDM4A | O75164 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28210982 | 0.91 | KDM4A (0.47) | KCNA5KDM4ANQO2CA12CA1 | |
| SCHEMBL6172012 | 0.90 | KCNA5 (0.44) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL1965799 | 0.89 | KCNA5 (0.50) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL1808874 | 0.87 | KCNA5 (0.56) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL6290025 | 0.86 | KCNA5 (0.50) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL26659635 | 0.86 | KCNA5 (0.55) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL6095753 | 0.85 | MEN1 (0.47) | KCNA5KDM4ANQO2HTTCA12 | |
| Water SCHEMBL30667520 | 0.83 | KCNA5 (0.53) | KCNA5KDM4ANQO2HTTCA12 | |
| SCHEMBL498661 | 0.82 | KCNA5 (0.67) | KCNA5KDM4AHTTCA12CA1 | |
| SCHEMBL30290973 | 0.82 | KCNA5 (0.47) | KCNA5KDM4ANQO2HTTCA12 |
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-105101970-B | β -lactamase inhibitor | 维纳拓尔斯制药公司 | 2018-11-20 | — | — | CN | disclosed |