Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.33 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9777384 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL1764669 | 0.81 | TSHR (0.38) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL10488673 | 0.80 | SMN1; SMN2 (0.65) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL7855792 | 0.79 | TP53 (0.36) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL7098338 | 0.77 | TP53 (0.39) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL7903146 | 0.77 | TP53 (0.35) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL937606 | 0.77 | TP53 (0.35) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL7926904 | 0.77 | SMN1; SMN2 (0.41) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL18272106 | 0.74 | TP53 (0.33) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL24910469 | 0.73 | SMN1; SMN2 (0.45) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A |
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-105461541-A | A preparing method of 2-methoxy-3,6-dichlorobenzoic acid | JIANGSU LIANHE CHEMICAL TECH CO LTD | 2016-04-06 | — | — | CN | disclosed |