Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27668825 | 0.82 | CA12 (0.37) | ALDH1A1MAPTLMNAGAAPOLB | |
| SCHEMBL27668775 | 0.73 | CYP19A1 (0.43) | — | |
| SCHEMBL27668770 | 0.71 | TDP1 (0.46) | ALDH1A1MAPTTDP1SRD5A2LMNA | |
| Iodide SCHEMBL11686704 | 0.70 | SNCA (0.41) | ALDH1A1MAPTLMNAGAAL3MBTL1 | |
| SCHEMBL10723714 | 0.67 | SRD5A2 (0.83) | ALDH1A1MAPTTDP1SRD5A2LMNA | |
| SCHEMBL975118 | 0.67 | SRD5A2 (0.83) | ALDH1A1MAPTTDP1SRD5A2LMNA | |
| SCHEMBL28250648 | 0.67 | ALDH1A1 (0.38) | ALDH1A1MAPTGAAPOLBHPGD | |
| SCHEMBL5462768 | 0.65 | CDYL2 (0.53) | ALDH1A1MAPTTDP1SRD5A2KMT2A | |
| Glyoxylate SCHEMBL28843434 | 0.64 | POLB (0.70) | ALDH1A1MAPTTDP1SRD5A2LMNA | |
| Alcohol SCHEMBL28113154 | 0.64 | MAPK1 (0.70) | ALDH1A1MAPTTDP1SRD5A2LMNA |
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-1886403-A | Use of a compound of formula (i) as an inhibitor of aromatase for therapeutic purposes and compounds of formula (1) thereas | YANG JI CHEMICAL COMPANY LTD (KR) | 2006-12-27 | — | — | CN | disclosed |