Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 2/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | PHGDH | O43175 | 1/20 | 0.31 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.31 |
| ▸ | FBP1 | P09467 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10664302 | 0.76 | ALDH1A1 (0.45) | ALDH1A1HPGDMAPTCA1CA2 | |
| SCHEMBL10662365 | 0.76 | ALDH1A1 (0.45) | ALDH1A1HPGDMAPTCA1CA2 | |
| SCHEMBL25539958 | 0.73 | CYP19A1 (0.36) | ALDH1A1MAPTMGLL | |
| SCHEMBL12562212 | 0.73 | FBP1 (0.38) | FBP1 | |
| SCHEMBL11225337 | 0.73 | ALDH1A1 (0.42) | ALDH1A1HPGDMAPTCA1CA2 | |
| SCHEMBL28290964 | 0.71 | ALDH1A1 (0.35) | ALDH1A1HPGDMAPTCA1CA2 | |
| SCHEMBL17122554 | 0.69 | NOS1 (0.39) | ALDH1A1HPGDHSD17B10FBP1 | |
| SCHEMBL5833837 | 0.68 | ALDH1A1 (0.52) | ALDH1A1HPGDMAPTCA2MEN1 | |
| SCHEMBL28278053 | 0.67 | ALDH1A1 (0.33) | ALDH1A1HPGD | |
| SCHEMBL17122535 | 0.63 | CA2 (0.60) | ALDH1A1CA1CA2CA12CA9 |
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-108690094-A | [Co2(dba)(bpe)(OH)](H2O)]Antiferromagnetic complex and preparation method thereof | 陕西科技大学 | 2018-10-23 | — | — | CN | disclosed |