Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.40 |
| ▸ | MAPT | P10636 | 9/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7684964 | 0.82 | HDAC6 (0.46) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| SCHEMBL5209026 | 0.80 | KCNH2 (0.47) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| Hydrochloric Acid SCHEMBL30753410 | 0.80 | ALDH1A1 (0.47) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| SCHEMBL7684962 | 0.77 | KCNH2 (0.47) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| SCHEMBL5209021 | 0.76 | ALDH1A1 (0.50) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| SCHEMBL27664597 | 0.70 | ACHE (0.41) | ALDH1A1MAPTTSHRKMT2AL3MBTL1 | |
| SCHEMBL2174173 | 0.69 | ALDH1A1 (0.67) | ALDH1A1MAPTRAB9AKDM4ENPC1 | |
| SCHEMBL15535616 | 0.69 | CYP1A2 (0.54) | KCNH2HRH3ALDH1A1MAPTRAB9A | |
| SCHEMBL790713 | 0.69 | CA1 (0.40) | ALDH1A1TSHRALOX15RECQL | |
| SCHEMBL3016819 | 0.68 | ALDH1A1 (0.47) | ALDH1A1MAPTRAB9AKDM4ENPC1 |
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-108419435-A | Compound and epigenetics for treating cancer | 新加坡科技研究局 | 2018-08-17 | — | — | CN | disclosed |