Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.48 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | CCR5 | P51681 | 1/20 | 0.48 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NOS2 | P35228 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | SYK | P43405 | 2/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11982 | 0.91 | — | — | |
| SCHEMBL12553822 | 0.91 | — | — | |
| SCHEMBL31701868 | 0.91 | — | — | |
| Benzoic Acid SCHEMBL27555286 | 0.76 | NPC1 (0.48) | CCR1CCR5CCR8KDM4ESMN1; SMN2 | |
| SCHEMBL29952078 | 0.71 | UHRF1 (0.50) | UHRF1CCR1CCR5CCR8KMT2A | |
| SCHEMBL1843835 | 0.71 | UHRF1 (0.50) | UHRF1CCR1CCR5CCR8KMT2A | |
| SCHEMBL155221 | 0.71 | LOXL2 (0.42) | KDM4ELOXL2ALDH1A1IDO1 | |
| SCHEMBL13453333 | 0.71 | LOXL2 (0.42) | KDM4ELOXL2ALDH1A1IDO1 | |
| SCHEMBL29649106 | 0.71 | LOXL2 (0.42) | KDM4ELOXL2ALDH1A1IDO1 | |
| SCHEMBL29738506 | 0.70 | LOXL2 (0.41) | KDM4ELOXL2ALDH1A1IDO1 |
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-116535389-A | 6-pyridine-3-quinoxaline urea derivative and application thereof | 四川大学 | 2023-08-04 | — | — | CN | disclosed |