Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | PCTP | Q9UKL6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28311648 | 0.87 | RAB9A (0.48) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL6203398 | 0.80 | LMNA (0.60) | RAB9ACYP1A2CYP2C19KDM4EPOLB | |
| SCHEMBL28639449 | 0.80 | RAB9A (0.48) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL28064220 | 0.77 | RAB9A (0.45) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL7748111 | 0.75 | RAB9A (0.83) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL9323154 | 0.71 | KMT2A (0.49) | MAPTMRGPRX1ALDH1A1HTTLMNA | |
| SCHEMBL27681 | 0.71 | ALDH1A1 (0.61) | TP53MAPTSLC22A12ALDH1A1HTT | |
| SCHEMBL11449454 | 0.69 | KDM4E (0.59) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL6202161 | 0.69 | HPGD (0.56) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL1122648 | 0.69 | KMT2A (0.49) | RAB9AMAPTALDH1A1SMN1; SMN2NPC1 |
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-105646298-A | 2-oxo-, 2-hydroxyl and 2-acyloxy-2-substituted phenyl ethyl sulfonamide compound and preparation method and application thereof as bactericide | 沈阳农业大学 | 2016-06-08 | — | — | CN | disclosed |