Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3013039 | 0.86 | CYP3A4 (0.58) | HSD17B10CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL632457 | 0.80 | BACE1 (0.47) | HSD17B10CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL3314453 | 0.79 | ALDH1A1 (0.56) | HSD17B10CYP3A4HPGDALDH1A1CA1 | |
| SCHEMBL3785424 | 0.75 | CYP3A4 (0.54) | HSD17B10CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL14742210 | 0.75 | CA1 (0.41) | HSD17B10CYP3A4HPGDALDH1A1CA1 | |
| SCHEMBL4851456 | 0.75 | CA1 (0.48) | HSD17B10CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL5430199 | 0.75 | CYP3A4 (0.50) | CYP3A4HPGDALDH1A1CA1CA2 | |
| SCHEMBL7221200 | 0.74 | HSD17B10 (0.46) | HSD17B10CYP3A4HPGDCRHBPCRHR2 | |
| SCHEMBL29433138 | 0.72 | BACE1 (0.39) | HSD17B10CYP3A4HPGDALDH1A1CA1 | |
| SCHEMBL766082 | 0.72 | BACE1 (0.39) | HSD17B10CYP3A4HPGDALDH1A1CA1 |
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-104876859-B | Pyrrole worm is grand and preparation method thereof | 常州佳灵药业有限公司 | 2018-03-13 | — | — | CN | disclosed |