Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.59 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.54 |
| ▸ | HTR1A | P08908 | 2/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | HTR2B | P41595 | 2/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10555636 | 0.85 | ALDH1A1 (0.68) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| Hydrochloric Acid SCHEMBL11480654 | 0.83 | ADRB2 (0.68) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| Hydrochloric Acid SCHEMBL11480657 | 0.83 | ADRB2 (0.68) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| SCHEMBL4049242 | 0.80 | ALDH1A1 (0.54) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| SCHEMBL10451642 | 0.79 | BCHE (0.71) | KMT2AMEN1ALDH1A1OPRK1CYP1A2 | |
| SCHEMBL11096038 | 0.79 | BCHE (0.71) | KMT2AMEN1ALDH1A1OPRK1CYP1A2 | |
| SCHEMBL14198232 | 0.79 | SIGMAR1 (0.66) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| SCHEMBL19498803 | 0.79 | OPRK1 (0.81) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| SCHEMBL13911191 | 0.79 | SIGMAR1 (0.66) | KMT2AMEN1ALDH1A1OPRK1ADRB2 | |
| SCHEMBL109557 | 0.78 | TSHR (0.53) | KMT2AMEN1OPRK1ADRB2ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019153216-A1 | SUBSTITUTED ARYLAMINO ALCOHOL COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 北京梅尔森医药技术开发有限公司 | 2019-08-15 | — | — | WO | disclosed |