Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.76 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL418439 | 0.86 | KMO (1.00) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL8195584 | 0.85 | KMO (0.69) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL6051833 | 0.84 | KMO (0.96) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL1088946 | 0.84 | KMO (0.71) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL1087826 | 0.84 | KMO (0.71) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL1088371 | 0.82 | KMO (0.69) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| Hydrogen Peroxide SCHEMBL11391460 | 0.82 | KMO (0.71) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL9338681 | 0.81 | KMO (0.73) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL12814215 | 0.81 | KMO (0.73) | KMOSERPINE1HDAC8HDAC4HDAC2 | |
| SCHEMBL15019437 | 0.81 | KMO (0.90) | KMOSERPINE1HDAC8HDAC4HDAC2 |
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-114956933-A | Marker containing isotope oxygen atom and preparation method and application thereof | 清华大学 | 2022-08-30 | — | — | CN | disclosed |