Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 2/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.36 |
| ▸ | CDK9 | P50750 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | MST1R | Q04912 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9529665 | 0.70 | CCR8 (0.39) | KDM4EALDH1A1HPGDHSD17B10KMT2A | |
| SCHEMBL29431921 | 0.69 | LRRK2 (0.33) | ALKCCNT1CDK9KDM4ELRRK2 | |
| SCHEMBL29431904 | 0.69 | LRRK2 (0.33) | ALKCCNT1CDK9KDM4ELRRK2 | |
| SCHEMBL18879715 | 0.68 | MAPT (0.40) | KDM4ELRRK2HTR6ALDH1A1MEN1 | |
| SCHEMBL28933807 | 0.67 | KDM4E (0.33) | CCNT1CDK9KDM4EADRA2BMAPK1 | |
| SCHEMBL28709574 | 0.66 | MAPT (0.32) | CCNT1CDK9KDM4EADRA2BMAPK1 | |
| SCHEMBL28700051 | 0.65 | HTR1A (0.34) | CCNT1CDK9KDM4EHTR6ALDH1A1 | |
| SCHEMBL28700084 | 0.65 | FFAR4 (0.33) | LRRK2MAPT | |
| SCHEMBL29431902 | 0.64 | LRRK2 (0.32) | HRH4LRRK2HTR6MAPT | |
| SCHEMBL1886773 | 0.61 | CCR8 (0.52) | KDM4EALDH1A1HSD17B10KMT2A |
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-113999250-A | Isoleucinine analogue prepared from ofloxacin as raw material, and preparation method and application thereof | 郑州工业应用技术学院 | 2022-02-01 | — | — | CN | disclosed |