Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28608905 | 0.84 | CTBP2 (0.44) | GLSL3MBTL1 | |
| SCHEMBL28612288 | 0.83 | PTGES (0.40) | GLSMAOB | |
| SCHEMBL28623769 | 0.83 | PIK3CA (0.45) | TSHRMEN1KMT2AMAPT | |
| SCHEMBL28604758 | 0.82 | HTT (0.44) | CYP2D6CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL28605788 | 0.82 | TSHR (0.45) | TSHRMEN1KMT2AMAPTL3MBTL1 | |
| SCHEMBL28605790 | 0.81 | CTBP2 (0.48) | ANPEPMEN1KMT2ARAB9A | |
| SCHEMBL28609788 | 0.78 | L3MBTL1 (0.44) | MEN1KMT2AL3MBTL1 | |
| SCHEMBL28920257 | 0.75 | HPGD (0.44) | MEN1KMT2AL3MBTL1RAB9ACNR2 | |
| SCHEMBL13799028 | 0.72 | NR4A2 (0.44) | SLC1A1MEN1KMT2AMAOBMAPT | |
| SCHEMBL10137784 | 0.72 | SLC1A1 (0.46) | ANPEPCYP2D6CYP2C9ALOX15TSHR |
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-109942612-B | Diyne enamine compound and preparation method and application thereof | 北京大学深圳研究生院 | 2021-08-20 | — | — | CN | disclosed |