Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28737753 | 1.00 | CYP1A2 (0.50) | CYP1A2KDM4ELMNASMN1; SMN2NR1H2 | |
| SCHEMBL28737943 | 0.88 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2NR1H2 | |
| SCHEMBL28737942 | 0.88 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2NR1H2 | |
| SCHEMBL28738065 | 0.88 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2NR1H2 | |
| SCHEMBL28470108 | 0.84 | CYP1A2 (0.49) | CYP1A2KDM4ELMNASMN1; SMN2TSHR | |
| SCHEMBL28470107 | 0.84 | CYP1A2 (0.49) | CYP1A2KDM4ELMNASMN1; SMN2TSHR | |
| SCHEMBL28737765 | 0.81 | CYP1A2 (0.48) | CYP1A2KDM4ELMNASMN1; SMN2MAPK1 | |
| SCHEMBL28737763 | 0.81 | CYP1A2 (0.48) | CYP1A2KDM4ELMNASMN1; SMN2MAPK1 | |
| SCHEMBL28737773 | 0.79 | KAT6A (0.42) | KDM4ELMNANR1H2NR1H3TSHR | |
| SCHEMBL28737851 | 0.79 | ADRB3 (0.47) | CYP1A2KDM4ELMNASMN1; SMN2TSHR |
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-109563103-B | Modulators of beta-3 adrenergic receptors for the treatment or prevention of disorders related thereto | 艾尼纳制药公司 | 2022-05-27 | — | — | CN | disclosed |