Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL6671979 | 0.87 | LMNA (0.52) | LMNAADRA2AMAPTALDH1A1ADORA2A | |
| Water SCHEMBL9462188 | 0.87 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL20852333 | 0.84 | LMNA (0.61) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL7709 | 0.84 | — | — | |
| SCHEMBL4916223 | 0.84 | LMNA (0.61) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| Nitrogen SCHEMBL11864887 | 0.82 | LMNA (0.55) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| Cyanide SCHEMBL28138043 | 0.82 | LMNA (0.55) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| Ammonia Solution, Strong SCHEMBL8429752 | 0.82 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| Ethane SCHEMBL29007244 | 0.82 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1L3MBTL1 | |
| Iodide SCHEMBL17710408 | 0.82 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1L3MBTL1 |
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-113444031-A | Synthetic method of 2, 2-diaryl acetonitrile compound | 兰州大学 | 2021-09-28 | — | — | CN | disclosed |