Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | STS | P08842 | 2/20 | 0.49 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CTSD | P07339 | 1/20 | 0.45 |
| ▸ | CTSE | P14091 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.45 |
| ▸ | OGA | O60502 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 4/20 | 0.43 |
| ▸ | MMP3 | P08254 | 4/20 | 0.43 |
| ▸ | MMP7 | P09237 | 4/20 | 0.43 |
| ▸ | MMP9 | P14780 | 4/20 | 0.43 |
| ▸ | MMP8 | P22894 | 3/20 | 0.43 |
| ▸ | MMP13 | P45452 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18280215 | 0.87 | GPR119 (0.52) | ALDH1A1MAPTKDM4EGPR119GRM5 | |
| SCHEMBL1870570 | 0.85 | NR1H2 (0.54) | ALDH1A1MAPTKDM4EGPR119LMNA | |
| SCHEMBL5497099 | 0.85 | MEN1 (0.55) | ALDH1A1STSLMNASMN1; SMN2HTT | |
| SCHEMBL14720896 | 0.85 | GRM5 (0.46) | ALDH1A1MAPTGPR119LMNASMN1; SMN2 | |
| SCHEMBL4635083 | 0.85 | GRM5 (0.46) | GPR119SMN1; SMN2GRM5OGAMMP13 | |
| SCHEMBL1012311 | 0.85 | ALDH1A1 (0.46) | ALDH1A1MAPTKDM4ESTSGPR119 | |
| SCHEMBL6396022 | 0.85 | ABCB1 (0.48) | ALDH1A1MAPTKDM4ESTSGPR119 | |
| SCHEMBL1473227 | 0.85 | GPR119 (0.51) | KDM4ESTSGPR119GRM5 | |
| SCHEMBL1602307 | 0.85 | OGA (0.46) | ALDH1A1MAPTKDM4EGPR119LMNA | |
| SCHEMBL20304919 | 0.84 | SRD5A2 (0.55) | MAPTGPR119GRM5OGA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014072930-A2 | FUSED PYRIDINE DERIVATIVES AS ANTIBACTERIAL AGENTS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2014-05-15 | — | — | WO | disclosed |