Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.30 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.30 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3253032 | 0.83 | TP53 (0.33) | LMNAKDM4ECYP1A2GABRR1 | |
| SCHEMBL186138 | 0.83 | GRIN2D (0.33) | LMNAKDM4ECYP1A2GABRR1 | |
| SCHEMBL1537296 | 0.83 | GRIN2D (0.33) | LMNAKDM4ECYP1A2GABRR1 | |
| SCHEMBL6369496 | 0.81 | TP53 (0.32) | LMNAKDM4ECYP1A2 | |
| SCHEMBL3008985 | 0.81 | KDM4E (0.30) | LMNAKDM4ECYP1A2 | |
| SCHEMBL3975721 | 0.81 | TP53 (0.32) | LMNAKDM4ECYP1A2 | |
| SCHEMBL4215424 | 0.81 | TP53 (0.32) | LMNAKDM4ECYP1A2 | |
| SCHEMBL1443592 | 0.81 | LMNA (0.30) | LMNAKDM4ECYP1A2 | |
| SCHEMBL4215465 | 0.81 | TP53 (0.32) | LMNAKDM4ECYP1A2 | |
| SCHEMBL599033 | 0.79 | SLC7A5 (0.41) | — |
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-108463451-A | The manufacturing method of hydroxy pivalin aldehyde | 三菱瓦斯化学株式会社 | 2018-08-28 | — | — | CN | disclosed |
| CN-105246512-A | Methods for improving lipid profiles using atrasentan | ABBVIE INC | 2016-01-13 | — | — | CN | disclosed |