Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.34 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | MARK3 | P27448 | 1/20 | 0.34 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.34 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.34 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16395487 | 0.78 | ALDH1A1 (0.43) | KDM4EALDH1A1ALOX15HSD17B10HPGD | |
| SCHEMBL7763434 | 0.75 | KMO (0.47) | KMOKDM4EALDH1A1ALOX15HPGD | |
| SCHEMBL2259692 | 0.74 | KMO (0.46) | KMOKDM4EALDH1A1ALOX15TSHR | |
| SCHEMBL18924951 | 0.73 | KMO (0.43) | KMOKDM4EALDH1A1ALOX15HSD17B10 | |
| SCHEMBL15976601 | 0.72 | KMO (0.45) | KMOKDM4EADORA3ADORA2A | |
| SCHEMBL12179933 | 0.72 | KMO (0.53) | KMOALDH1A1LMNAMAPK1MYC | |
| Hydrochloric Acid SCHEMBL2259353 | 0.71 | KMO (0.51) | KMOALDH1A1LMNAMAPK1MYC | |
| SCHEMBL14983680 | 0.70 | CHEK1 (0.41) | ALDH1A1HSD17B10CHEK1AURKALRRK2 | |
| SCHEMBL31082043 | 0.69 | HPGD (0.42) | KDM4EALDH1A1HPGDTSHRLMNA | |
| SCHEMBL31504047 | 0.68 | KMO (0.38) | KMOKDM4EALDH1A1ALOX15HPGD |
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-105636646-B | Azaindole compounds, its synthesis and its application method | 全球结核病药物研发联盟 | 2017-12-19 | — | — | CN | disclosed |
| CN-105636646-A | Azaindole compounds, synthesis thereof, and methods of using the same | GLOBAL ALLIANCE FOR TB DRUG DEV | 2016-06-01 | — | — | CN | disclosed |