Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.37 |
| ▸ | DRD3 | P35462 | 3/20 | 0.37 |
| ▸ | DRD4 | P21917 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2220775 | 0.91 | CYP2C19 (0.44) | CYP2C19HIF1ACYP1A2PTGS2CYP2D6 | |
| SCHEMBL374784 | 0.82 | CYP2C19 (0.57) | CYP2C19HIF1ACHRM2CHRM1CHRM3 | |
| SCHEMBL28306699 | 0.80 | KCNN4 (0.50) | CYP2C19HIF1ACYP1A2PTGS2KMT2A | |
| SCHEMBL28306690 | 0.80 | KCNN4 (0.50) | CYP2C19HIF1ACYP1A2PTGS2KMT2A | |
| SCHEMBL28306747 | 0.80 | POLB (0.45) | CYP2C19HIF1AOPRM1DRD3DRD2 | |
| SCHEMBL28305527 | 0.79 | CYP2C19 (0.52) | CYP2C19HIF1ACHRM2CHRM1CHRM3 | |
| SCHEMBL20564089 | 0.78 | ITGB3 (0.40) | CHRM2SMN1; SMN2POLBALDH1A1TSHR | |
| SCHEMBL29279074 | 0.78 | TDP1 (0.47) | CYP2C19HIF1ACYP1A2CYP2D6KMT2A | |
| SCHEMBL28305534 | 0.78 | CYP2C19 (0.42) | CYP2C19HIF1ACHRM2CHRM1CHRM3 | |
| SCHEMBL29178237 | 0.77 | CYP2C19 (0.44) | CYP2C19HIF1APTGS2CYP2D6SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117567225-A | Method for preparing dicarboxylic acid compound from olefin | 徐州医科大学 | 2024-02-20 | — | — | CN | disclosed |
| CN-110028403-B | Method for synthesizing succinic acid compound | 四川大学 | 2020-08-11 | — | — | CN | disclosed |
| CN-110028403-A | A kind of method of synthesizing succinic acid class compound | 四川大学 | 2019-07-19 | — | — | CN | disclosed |