Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 6/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL6836192 | 0.87 | GAA (0.60) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL7764411 | 0.85 | KMT2A (0.54) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6838424 | 0.83 | LMNA (0.56) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6836552 | 0.83 | KMT2A (0.61) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6836389 | 0.82 | CXCR2 (0.63) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6835468 | 0.82 | GAA (0.61) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6572962 | 0.81 | ALDH1A1 (0.73) | KMT2AMEN1CXCR2GAANPC1 | |
| Hydrochloric Acid SCHEMBL9313818 | 0.81 | GAA (0.60) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL6836397 | 0.80 | GAA (0.59) | KMT2AMEN1CXCR2GAANPC1 | |
| SCHEMBL7763193 | 0.79 | KMT2A (0.59) | KMT2AMEN1CXCR2GAANPC1 |
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-108026027-B | Substituted malonamide compounds and their use as antibacterial agents | 邱浩杰 | 2020-10-02 | — | — | CN | disclosed |