Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.40 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 4/20 | 0.37 |
| ▸ | CTSA | P10619 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL18015820 | 0.78 | HTR1B (0.43) | HSD17B14KMOTGFBR1PTGER1CTSA | |
| SCHEMBL16385171 | 0.77 | HSD17B1 (0.45) | HSD17B14GAAMEN1KMT2A | |
| SCHEMBL15864394 | 0.76 | CYP11B2 (0.49) | KMOTGFBR1CYP1A2CYP3A4 | |
| SCHEMBL7958260 | 0.76 | GPBAR1 (0.36) | EGFRERBB3GRM5GAAMAPT | |
| Ammonia Solution, Strong SCHEMBL5380432 | 0.75 | ALDH1A1 (0.55) | L3MBTL1MEN1ALDH1A1CYP1A2KMT2A | |
| SCHEMBL28115227 | 0.74 | CCR1 (0.52) | TGFBR1GRM5MAPTALDH1A1CYP1A2 | |
| SCHEMBL29901533 | 0.74 | CCR1 (0.52) | TGFBR1GRM5MAPTALDH1A1CYP1A2 | |
| SCHEMBL18014722 | 0.74 | TGFBR1 (0.37) | HSD17B14TGFBR1PTGER1CTSA | |
| SCHEMBL16385306 | 0.74 | CYP1A2 (0.40) | EGFRGAACTSAJAK2MEN1 | |
| SCHEMBL30226663 | 0.73 | ACLY (0.40) | TGFBR1GRM5 |
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-106132950-A | Compounds and methods of use | 麦迪韦逊技术股份有限公司 | 2016-11-16 | — | — | CN | disclosed |