Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | RXRA | P19793 | 1/20 | 0.53 |
| ▸ | RXRB | P28702 | 1/20 | 0.53 |
| ▸ | RXRG | P48443 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | VCP | P55072 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Terephthalic Acid SCHEMBL29049219 | 0.81 | HSD17B10 (0.60) | ALDH1A1POLBHPGDHSD17B10CTDSP1 | |
| SCHEMBL747792 | 0.80 | HDAC1 (0.65) | HDAC6HDAC8HDAC1HDAC3HDAC4 | |
| Benzoic Acid SCHEMBL29049235 | 0.78 | HSD17B10 (0.56) | ALDH1A1POLBHPGDHSD17B10CTDSP1 | |
| SCHEMBL436159 | 0.78 | APEX1 (0.54) | ALDH1A1HPGDKMT2AHDAC6HDAC8 | |
| SCHEMBL1242337 | 0.77 | CA1 (0.43) | KMT2AHDAC6HDAC8HDAC3 | |
| SCHEMBL29089528 | 0.75 | ALDH1A1 (0.56) | ALDH1A1POLBHPGDHSD17B10CTDSP1 | |
| SCHEMBL151049 | 0.74 | AGTR1 (0.56) | ALDH1A1HPGDKMT2A | |
| Isophthalic Acid SCHEMBL29049251 | 0.73 | HDAC1 (0.51) | ALDH1A1POLBHPGDHSD17B10CTDSP1 | |
| SCHEMBL693716 | 0.73 | ALDH1A1 (0.69) | ALDH1A1POLBHPGDHSD17B10CTDSP1 | |
| SCHEMBL9194246 | 0.73 | ALDH1A1 (0.69) | ALDH1A1POLBHPGDHSD17B10CTDSP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2429987-A2 | AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | Korea Research Institute Of Chemical Technology (KR) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010131922-A2 | AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2010-11-18 | — | — | WO | disclosed |