Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PTPN7 | P35236 | 3/20 | 0.33 |
| ▸ | HMGCR | P04035 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28008580 | 0.96 | MAPT (0.44) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28008586 | 0.92 | TSHR (0.42) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28009088 | 0.87 | TSHR (0.44) | MAPTTSHRTHRBPOLBAPEX1 | |
| Hexanoate SCHEMBL28008581 | 0.86 | TSHR (0.55) | HSD17B10TSHRTDP1PTPN7HMGCR | |
| Valeric Acid SCHEMBL28818284 | 0.85 | TSHR (0.53) | HSD17B10TSHRTHRBTDP1PTPN7 | |
| SCHEMBL28008638 | 0.84 | THRB (0.43) | TSHRTHRBPOLBAPEX1HTT | |
| Butyric Acid SCHEMBL28009061 | 0.81 | TSHR (0.47) | TSHRTHRBPOLBAPEX1HTT | |
| Acetic Acid SCHEMBL28158415 | 0.81 | THRB (0.48) | TSHRTHRBPOLBAPEX1HTT | |
| SCHEMBL33780 | 0.81 | THRB (0.52) | CYP1A2TSHRTHRBPOLBAPEX1 | |
| Propionic Acid SCHEMBL28009092 | 0.79 | THRB (0.49) | TSHRTHRBPOLBAPEX1HTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104795595-A | Nonaqueous electrolyte solution and electrochemical element using same | UBE INDUSTRIES | 2015-07-22 | — | — | CN | disclosed |
| CN-102498605-B | Nonaqueous electrolyte solution and electrochemical element using same | UBE INDUSTRIES | 2015-05-20 | — | — | CN | disclosed |