Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4674573 | 0.81 | HDAC6 (0.55) | DAOTP53NPC1RAB9AHDAC6 | |
| SCHEMBL27605039 | 0.79 | ALDH1A1 (0.49) | ERN1DAOPTPN1MEN1KMT2A | |
| SCHEMBL15563307 | 0.79 | DAO (0.57) | DAOMEN1KMT2ALMNAMAPT | |
| SCHEMBL15563309 | 0.79 | DAO (0.57) | DAOMEN1KMT2ALMNAMAPT | |
| SCHEMBL3308924 | 0.78 | ALDH1A1 (0.60) | DAOMEN1KMT2ALMNAMAPT | |
| SCHEMBL3308926 | 0.78 | ALDH1A1 (0.60) | DAOMEN1KMT2ALMNAMAPT | |
| SCHEMBL14019381 | 0.76 | KDM4E (0.47) | ERN1PTPN1LMNAMAPTALDH1A1 | |
| SCHEMBL27555754 | 0.76 | ERN1 (0.37) | ERN1PTPN1MEN1KMT2AHDAC2 | |
| SCHEMBL4671146 | 0.75 | ALDH1A1 (0.37) | DAOMEN1KMT2ALMNAMAPT | |
| SCHEMBL4674929 | 0.75 | ALDH1A1 (0.37) | DAOMEN1KMT2ALMNAMAPT |
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-1335834-A | Aromatic heterocyclic compounds having HIV integrase inhibitory activity | SHIONOGI & CO (JP) | 2002-02-13 | — | — | CN | disclosed |