Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CCR2 | P41597 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28069398 | 0.80 | RAB9A (0.49) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL28311648 | 0.79 | RAB9A (0.48) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL28064220 | 0.79 | RAB9A (0.45) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL28646171 | 0.72 | HSD11B1 (0.47) | RAB9ANPC1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL9323154 | 0.70 | KMT2A (0.49) | HTTALDH1A1MAPTGAAMRGPRX1 | |
| SCHEMBL7573311 | 0.70 | RAB9A (0.68) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL9499786 | 0.70 | KMT2A (0.46) | MAPTSMN1; SMN2CCR2MRGPRX1KMT2A | |
| SCHEMBL12609252 | 0.70 | RAB9A (0.62) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL10885626 | 0.68 | RAB9A (0.69) | RAB9ACYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL1122648 | 0.68 | KMT2A (0.49) | RAB9ANPC1ALDH1A1MAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113402426-B | N-substituted-3, 3-dimethyl-2-oxo-butanesulfonamide compound as well as preparation method and application thereof | 沈阳农业大学 | 2023-05-26 | — | — | CN | disclosed |
| CN-113402426-A | N-substituted-3, 3-dimethyl-2-oxobutanesulfonamide compound and preparation method and application thereof | 沈阳农业大学 | 2021-09-17 | — | — | CN | disclosed |