Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT1 | Q99873 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL21246885 | 0.81 | ALDH1A1 (0.51) | SIGMAR1ADRB2ADRB1ADRB3 | |
| SCHEMBL28552086 | 0.80 | POLB (0.45) | PRMT1POLBHTR2ASIGMAR1 | |
| SCHEMBL28548618 | 0.80 | ADRB3 (0.52) | HTR2ASIGMAR1ADRB2ADRB1ADRB3 | |
| SCHEMBL21259419 | 0.73 | CYP2D6 (0.46) | ADRB2ADRB1ADRB3 | |
| SCHEMBL7297780 | 0.71 | ADRB3 (0.68) | ADRB2ADRB1ADRB3 | |
| SCHEMBL7285328 | 0.70 | ADRB3 (0.67) | ADRB2ADRB1ADRB3 | |
| SCHEMBL7296273 | 0.70 | ADRB3 (0.67) | ADRB2ADRB1ADRB3 | |
| SCHEMBL6534491 | 0.70 | SLC2A1 (0.55) | — | |
| SCHEMBL6534493 | 0.70 | SLC2A1 (0.55) | — | |
| SCHEMBL2278702 | 0.69 | KDR (0.52) | POLB |
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 3 patents. 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 | claimed |
| CN-108299279-B | Substituted arylaminol compounds, methods of making, and uses thereof | 北京梅尔森医药技术开发有限公司 | 2021-03-23 | — | — | CN | disclosed |
| 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 |