Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.42 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28470108 | 1.00 | CYP1A2 (0.49) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28738065 | 0.86 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28737943 | 0.86 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28737942 | 0.86 | CYP1A2 (0.52) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28737751 | 0.84 | CYP1A2 (0.50) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28737753 | 0.84 | CYP1A2 (0.50) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28472200 | 0.82 | ALDH1A1 (0.39) | KDM4ELMNAL3MBTL1ALDH1A1GAA | |
| SCHEMBL28737765 | 0.80 | CYP1A2 (0.48) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28737763 | 0.80 | CYP1A2 (0.48) | CYP1A2KDM4ELMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL28468656 | 0.80 | POLB (0.46) | KDM4EL3MBTL1ALDH1A1GAAPKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111699189-B | Modulators of beta-3 adrenergic receptors useful for treating or preventing heart failure and disorders associated therewith | 艾尼纳制药公司 | 2025-02-18 | — | — | CN | disclosed |
| CN-111699189-A | Modulators of beta-3 adrenergic receptors useful for the treatment or prevention of heart failure and disorders associated therewith | 艾尼纳制药公司 | 2020-09-22 | — | — | CN | disclosed |