Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 9/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | RECQL | P46063 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | CASP7 | P55210 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28548969 | 0.88 | ALDH1A1 (0.45) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL9320811 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL4550664 | 0.78 | ALDH1A1 (0.47) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL1044921 | 0.75 | ALDH1A1 (0.45) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL54507 | 0.75 | KMT2A (0.47) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL9483013 | 0.73 | ALDH1A1 (0.43) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL9622239 | 0.72 | PLAU (0.61) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL10871679 | 0.71 | CA1 (0.41) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL11376213 | 0.71 | CA1 (0.41) | ALDH1A1CA1CA2CA9TSHR | |
| SCHEMBL317719 | 0.71 | CA1 (0.46) | ALDH1A1CA1CA2CA9TSHR |
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-108421541-B | Preparation method and application of Zn-carbide-based MOFs extraction coating | 南京大学 | 2021-04-27 | — | — | CN | disclosed |