Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 4/20 | 0.37 |
| ▸ | RARB | P10826 | 4/20 | 0.37 |
| ▸ | RARG | P13631 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.32 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17843543 | 0.87 | LMNA (0.37) | RARARARBRARGLMNAGFER | |
| SCHEMBL19599548 | 0.87 | LMNA (0.37) | RARARARBRARGLMNAGFER | |
| SCHEMBL17864569 | 0.87 | LMNA (0.37) | RARARARBRARGLMNAGFER | |
| SCHEMBL17843572 | 0.76 | RARA (0.50) | RARARARBRARGKMT2AKDM4E | |
| SCHEMBL17864639 | 0.69 | KDM4E (0.38) | RARARARBRARGKDM4E | |
| SCHEMBL252154 | 0.67 | ALDH1A1 (0.41) | RARARARBRARGGFERKMT2A | |
| SCHEMBL17730412 | 0.65 | LMNA (0.51) | LMNAGFERKMT2AL3MBTL1CYP3A4 | |
| SCHEMBL4509810 | 0.65 | LMNA (0.51) | LMNAGFERKMT2AL3MBTL1CYP3A4 | |
| SCHEMBL17737809 | 0.65 | LMNA (0.51) | LMNAGFERKMT2AL3MBTL1CYP3A4 | |
| SCHEMBL29875584 | 0.65 | TSHR (0.53) | LMNAGFERKMT2AL3MBTL1CYP3A4 |
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-2016097004-A1 | BICYCLOHETEROARYL-HETEROARYL-BENZOIC ACID COMPOUNDS AS RETINOIC ACID RECEPTOR BETA (RARβ) AGONISTS | KING'S COLLEGE LONDON (GB) | 2016-06-23 | — | — | WO | disclosed |