Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28749497 | 0.79 | AOC3 (0.52) | HSD17B10KDM4EALDH1A1MAPTPDE4D | |
| SCHEMBL12725989 | 0.76 | BCHE (0.58) | KMT2AMEN1THRBKDM4EALDH1A1 | |
| Formic Acid Methyl Ester SCHEMBL28740581 | 0.75 | AOC3 (0.46) | PDE4DLMNAAOC3BCHEPDGFRB | |
| Formic Acid SCHEMBL27487240 | 0.75 | PDE4D (0.48) | PDE4DLMNAAOC3SMN1; SMN2SMPD1 | |
| SCHEMBL26985270 | 0.75 | AOC3 (0.55) | MAPTTDP1AOC3SMN1; SMN2 | |
| SCHEMBL22543260 | 0.74 | AOC3 (0.45) | KMT2AMEN1ALDH1A1MAPTTDP1 | |
| SCHEMBL12772157 | 0.74 | KMT2A (0.60) | HSD17B10KMT2AMEN1THRBKDM4E | |
| SCHEMBL4681950 | 0.72 | L3MBTL1 (0.42) | HSD17B10KMT2AMEN1THRBKDM4E | |
| SCHEMBL19732195 | 0.72 | MAPT (0.58) | HSD17B10KMT2AMEN1THRBKDM4E | |
| SCHEMBL17913257 | 0.72 | PIN1 (0.50) | KMT2AMEN1THRBMAPTLMNA |
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-105744936-A | Substituted quinolizine derivatives useful as HIV integrase inhibitors | 默沙东公司 | 2016-07-06 | — | — | CN | disclosed |