Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 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 | |
|---|---|---|---|---|
| Chlorobenzene SCHEMBL28202229 | 0.93 | MAPT (0.49) | KMT2AMEN1MAPTHTTRAB9A | |
| SCHEMBL17187946 | 0.85 | MAPT (0.69) | KMT2AMEN1MAPTHTTRAB9A | |
| SCHEMBL28193245 | 0.85 | MAPT (0.69) | KMT2AMEN1MAPTHTTRAB9A | |
| SCHEMBL75640 | 0.85 | MAPT (0.69) | KMT2AMEN1MAPTHTTRAB9A | |
| Ammonia Solution, Strong SCHEMBL17180520 | 0.83 | MAPT (0.67) | KMT2AMEN1MAPTHTTRAB9A | |
| Hydrochloric Acid SCHEMBL27858043 | 0.83 | MAPT (0.67) | KMT2AMEN1MAPTHTTRAB9A | |
| 1,4-Dichlorobenzene SCHEMBL27455358 | 0.82 | MAPK1 (0.53) | HTTSMN1; SMN2CES2CES1GSK3B | |
| Propionaldehyde SCHEMBL28318171 | 0.82 | SMN1; SMN2 (0.57) | KMT2AMEN1MAPTHTTRAB9A | |
| 4-Hydroxyacetophenone SCHEMBL27822543 | 0.82 | HSD17B1 (0.63) | KMT2AMEN1MAPTHTTRAB9A | |
| Nitrogen SCHEMBL27858242 | 0.81 | MAPT (0.64) | KMT2AMEN1MAPTHTTRAB9A |
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-109046463-A | Bidentate azepine Cabbeen Mn catalyst and preparation method thereof and alkylation synthesis application | 中山大学 | 2018-12-21 | — | — | CN | disclosed |