Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 8/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | KHK | P50053 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22790352 | 0.95 | NR4A2 (0.48) | NR4A2MEN1KMT2AKDM4EKHK | |
| SCHEMBL22790131 | 0.88 | SIRT6 (0.56) | NR4A2MEN1KMT2AKDM4EKHK | |
| SCHEMBL22790260 | 0.87 | NR4A2 (0.46) | NR4A2MEN1KMT2AKDM4ELMNA | |
| SCHEMBL22790174 | 0.85 | NR4A2 (0.47) | NR4A2MEN1KMT2AKDM4EKHK | |
| SCHEMBL1096244 | 0.84 | NR4A2 (0.51) | NR4A2MEN1KMT2AKDM4ELMNA | |
| SCHEMBL22790129 | 0.82 | NR4A2 (0.49) | NR4A2MEN1KMT2AKDM4ELMNA | |
| SCHEMBL22790088 | 0.82 | NR4A2 (0.46) | NR4A2MEN1KMT2AKDM4ELMNA | |
| SCHEMBL22789951 | 0.82 | NR4A2 (0.46) | NR4A2MEN1KMT2AKDM4ELMNA | |
| SCHEMBL22790239 | 0.82 | MEN1 (0.43) | NR4A2MEN1KMT2AKDM4EKHK | |
| SCHEMBL22790343 | 0.81 | KHK (0.46) | KHKADRB1HTR3EHTR3BHTR3A |
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-2020249064-A1 | COMPOUNDS FOR MODULATING FXR | NANJING RUIJIE PHARMA CO., LTD. (CN) | 2020-12-17 | — | — | WO | disclosed |