Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | GLA | P06280 | 2/20 | 0.57 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.57 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.48 |
| ▸ | ALDH1B1 | P30837 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL28646880 | 0.85 | HSD17B3 (0.79) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL24627780 | 0.80 | MAPT (0.72) | KDM4EMAPTGAATHRBALDH1A1 | |
| Ocimarin SCHEMBL23752453 | 0.76 | HSD17B3 (0.79) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL18392236 | 0.75 | SRC (0.73) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL8745753 | 0.73 | NQO1 (0.61) | KDM4EMAPTGAAHSD17B3THRB | |
| SCHEMBL971942 | 0.73 | KDM4E (1.00) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL17941686 | 0.73 | KDM4E (0.61) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL6828193 | 0.72 | PDE2A (0.53) | KDM4EMAPTGAANPSR1ALDH1A1 | |
| SCHEMBL24589380 | 0.71 | ALDH1A1 (0.81) | KDM4EMAPTGAAGLAHSD17B3 | |
| SCHEMBL6584895 | 0.71 | KDM4E (0.79) | KDM4EMAPTGAAGLAHSD17B3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113493449-B | NO donor coumarin furazan conjugate and pharmaceutical application thereof | 复旦大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-113493449-A | NO donor coumarin furazan conjugate and pharmaceutical application thereof | 复旦大学 | 2021-10-12 | — | — | CN | disclosed |