Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.57 |
| ▸ | RORC | P51449 | 4/20 | 0.56 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.52 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.52 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | ESRRA | P11474 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6811191 | 0.91 | ALDH1A1 (0.60) | KDRRORCMAP2K1TRPV1ALDH1A1 | |
| SCHEMBL462753 | 0.87 | KDR (0.76) | KDRTRPV1PDK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL4556067 | 0.86 | KDR (0.75) | KDRTRPV1PDK1SMN1; SMN2MEN1 | |
| SCHEMBL11787916 | 0.85 | KDR (0.58) | KDRTRPV1PDK1SMN1; SMN2MEN1 | |
| SCHEMBL5248618 | 0.85 | KDR (0.58) | KDRTRPV1PDK1SMN1; SMN2MEN1 | |
| SCHEMBL6811196 | 0.84 | RORC (0.44) | KDRRORCMAP2K1TRPV1PDK1 | |
| SCHEMBL11831657 | 0.84 | KDR (0.62) | KDRTRPV1PDK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL5742985 | 0.83 | KDR (0.57) | KDRPDK1ALDH1A1SMN1; SMN2MEN1 | |
| Fluoride SCHEMBL11787921 | 0.83 | KDR (0.57) | KDRTRPV1PDK1MEN1KMT2A | |
| SCHEMBL11201462 | 0.83 | APEX1 (0.67) | KDRTRPV1PDK1MEN1KMT2A |
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-110003176-A | Benzimidazoles compound and its application containing amide | 沈阳药科大学 | 2019-07-12 | — | — | CN | disclosed |