Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.35 |
| ▸ | SOD3 | P08294 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23652744 | 0.91 | PDCD1 (0.42) | CXCR4PDCD1CD274SOD3HDAC6 | |
| SCHEMBL22831695 | 0.86 | PDCD1 (0.36) | CXCR4PDCD1CD274SOD3CHRNB2 | |
| SCHEMBL22887771 | 0.85 | CHRNB2 (0.38) | CXCR4PDCD1CD274SOD3PNMT | |
| SCHEMBL24535290 | 0.84 | PDCD1 (0.33) | CXCR4PDCD1CD274SOD3HDAC6 | |
| SCHEMBL24535881 | 0.84 | BAZ2B (0.41) | CXCR4PDCD1CD274HDAC6 | |
| SCHEMBL30793821 | 0.84 | PLAT (0.39) | PDCD1CD274HDAC6 | |
| Hydrochloric Acid SCHEMBL25335409 | 0.84 | CHRNB2 (0.37) | CXCR4PDCD1CD274SOD3PNMT | |
| Hydrochloric Acid SCHEMBL30917804 | 0.83 | SOD3 (0.33) | CXCR4PDCD1CD274SOD3HDAC6 | |
| SCHEMBL31207896 | 0.83 | PDCD1 (0.33) | CXCR4PDCD1CD274SOD3HDAC6 | |
| Hydrochloric Acid SCHEMBL25434869 | 0.83 | SOD3 (0.33) | CXCR4PDCD1CD274SOD3HDAC6 |
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-3851436-A1 | NOVEL HETEROAROMATIC AMIDE DERIVATIVE AND MEDICINE CONTAINING SAME | Kaken Pharmaceutical Co., Ltd. (JP) | 2021-07-21 | — | — | EP | disclosed |