Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.31 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.31 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23147725 | 0.82 | LPO (0.33) | SLC22A12NOTUMKDM4EALDH1A1 | |
| SCHEMBL29721895 | 0.82 | LPO (0.33) | SLC22A12NOTUMKDM4EALDH1A1 | |
| SCHEMBL28810673 | 0.76 | SLC22A12 (0.34) | SLC22A12NOTUMKEAP1NFE2L2ENPP3 | |
| SCHEMBL28809800 | 0.75 | — | — | |
| SCHEMBL3006109 | 0.70 | SLC22A12 (0.61) | SLC22A12NOTUMENPP3ENPP1 | |
| SCHEMBL21617815 | 0.70 | DAO (0.39) | SLC22A12NOTUMENPP3ENPP1KDM4E | |
| SCHEMBL24843803 | 0.69 | — | — | |
| SCHEMBL15569948 | 0.68 | PARP1 (0.31) | PARP1 | |
| SCHEMBL580829 | 0.67 | ENPP3 (0.59) | SLC22A12NOTUMENPP3ENPP1KDM4E | |
| SCHEMBL23147851 | 0.67 | — | — |
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-114746090-A | Azaindole carboxamide compounds for the treatment of mycobacterial infections | 结核病药物开发全球联盟公司 | 2022-07-12 | — | — | CN | disclosed |