Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2093308 | 0.85 | ADRB1 (0.63) | ADRB1MAPTNPC1KCNH2DRD2 | |
| SCHEMBL11074672 | 0.84 | ADRB1 (0.76) | ADRB1MAPTNPC1KCNH2DRD2 | |
| SCHEMBL2093305 | 0.83 | ADRB1 (0.61) | ADRB1MAPTNPC1KCNH2DRD2 | |
| SCHEMBL20129611 | 0.83 | ADRB1 (0.61) | ADRB1MAPTNPC1KCNH2DRD2 | |
| Ammonia Solution, Strong SCHEMBL8124587 | 0.83 | ADRB1 (0.61) | ADRB1MAPTNPC1KCNH2DRD2 | |
| SCHEMBL25493023 | 0.83 | LRRK2 (0.47) | ADRB1MAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL23428585 | 0.83 | NPY1R (0.49) | MAPTNPC1DRD2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL25307997 | 0.82 | ADRB1 (0.59) | ADRB1MAPTNPC1KCNH2DRD2 | |
| Hydrochloric Acid SCHEMBL30475416 | 0.82 | ADRB1 (0.59) | ADRB1MAPTNPC1KCNH2DRD2 | |
| SCHEMBL5798727 | 0.81 | NOTUM (0.59) | ADRB1MAPTNPC1KMT2ASMN1; SMN2 |
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-2021145729-A1 | NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF | DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) | 2021-07-22 | — | — | WO | disclosed |