Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 2/20 | 0.34 |
| ▸ | LDHB | P07195 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7954659 | 0.92 | ALDH1A1 (0.39) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL10618701 | 0.92 | ALDH1A1 (0.39) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL7863970 | 0.90 | ALDH1A1 (0.38) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL26841743 | 0.86 | ALDH1A1 (0.39) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL1953847 | 0.86 | ALDH1A1 (0.41) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL28743710 | 0.86 | ALDH1A1 (0.41) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL4899263 | 0.85 | DPP4 (0.43) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL70425 | 0.85 | DPP4 (0.43) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| Hydrochloric Acid SCHEMBL11858935 | 0.84 | ALDH1A1 (0.38) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 | |
| SCHEMBL28840200 | 0.83 | ALDH1A1 (0.40) | ALDH1A1MAPK1SMN1; SMN2HCAR2DPP4 |
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-105294419-A | Synthesis methods of 3, 6-dichloro-2-methoxybenzoic acid and its intermediate | JIANGSU LIANHE CHEMICAL TECHNOLOGY CO LTD | 2016-02-03 | — | — | CN | disclosed |