Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.74 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28584024 | 1.00 | SLC22A12 (0.74) | SLC22A12HTTALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28595214 | 0.89 | SLC22A12 (0.60) | SLC22A12ALDH1A1MAPTSMN1; SMN2POLB | |
| SCHEMBL28589808 | 0.85 | SLC22A12 (1.00) | SLC22A12HTTSMN1; SMN2CNR2CYP1A2 | |
| SCHEMBL28914924 | 0.84 | SLC22A12 (0.66) | SLC22A12HTTALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL29929026 | 0.83 | SLC22A12 (0.79) | SLC22A12HTTSMN1; SMN2CNR2CYP1A2 | |
| SCHEMBL28577788 | 0.83 | SLC22A12 (0.79) | SLC22A12HTTSMN1; SMN2CNR2CYP1A2 | |
| SCHEMBL28589443 | 0.82 | SLC22A12 (0.78) | SLC22A12HTTALDH1A1SMN1; SMN2POLB | |
| SCHEMBL28914786 | 0.82 | SLC22A12 (0.78) | SLC22A12HTTALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28595188 | 0.81 | SLC22A12 (0.80) | SLC22A12HTTALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28577420 | 0.81 | SLC22A12 (0.72) | SLC22A12HTTALDH1A1MAPTCNR2 |
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-113004188-B | Indole derivative, preparation method and application | 沈阳药科大学 | 2022-09-20 | — | — | CN | disclosed |