Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 9/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CCNK | O75909 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | HTR7 | P34969 | 2/20 | 0.31 |
| ▸ | HTR6 | P50406 | 2/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18420199 | 0.81 | KDM4A (0.40) | KDM4AKDM5BCYP11B2CYP11B1SLC22A12 | |
| SCHEMBL18436763 | 0.79 | HRH4 (0.38) | KDM4AKDM5BCYP11B2CYP11B1HRH4 | |
| SCHEMBL17127865 | 0.78 | RET (0.41) | HRH4HTR1ADRD2HTR7HTR6 | |
| SCHEMBL18436916 | 0.76 | DPP4 (0.34) | HRH4CCNT1CCNKCCNA2CDK2 | |
| SCHEMBL21336647 | 0.76 | KDM1A (0.36) | HRH4CCNA2CDK2 | |
| SCHEMBL21336936 | 0.75 | PDE9A (0.34) | HRH4 | |
| SCHEMBL18436930 | 0.73 | POLB (0.39) | KDM4AKDM5BCYP11B2CYP11B1CNR2 | |
| SCHEMBL18436545 | 0.73 | MTNR1A (0.39) | KDM4AKDM5BCYP11B2CYP11B1CNR2 | |
| SCHEMBL21336770 | 0.72 | EGLN1 (0.40) | EGLN1 | |
| SCHEMBL17128231 | 0.71 | BRS3 (0.45) | KDM4AKDM5BCYP11B2CYP11B1SLC22A12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |