Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 8/20 | 0.51 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | KHK | P50053 | 1/20 | 0.42 |
| ▸ | PRPS1 | P60891 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PLAT | P00750 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19202571 | 0.88 | NR4A2 (0.53) | NR4A2PRPS1BRD4MEN1ALDH1A1 | |
| SCHEMBL1096569 | 0.87 | NR4A2 (0.52) | NR4A2PRPS1BRD4MEN1ALDH1A1 | |
| SCHEMBL1095771 | 0.87 | NR4A2 (0.52) | NR4A2PRPS1BRD4MEN1ALDH1A1 | |
| SCHEMBL22790300 | 0.86 | NR4A2 (0.47) | NR4A2PRPS1BRD4MEN1ALDH1A1 | |
| SCHEMBL22790043 | 0.79 | SCN9A (0.52) | NR4A2ALDH1A1KMT2AKDM4EMAPT | |
| SCHEMBL13645913 | 0.77 | HTR2C (0.48) | TLR9TLR8SMN1; SMN2PLATMAPT | |
| SCHEMBL22790093 | 0.77 | NR4A2 (0.52) | NR4A2KHKBRD4MEN1ALDH1A1 | |
| SCHEMBL15167291 | 0.77 | ACMSD (0.44) | MEN1KMT2ALMNA | |
| SCHEMBL28472685 | 0.76 | APP (0.55) | APPBRD4KDM1A | |
| Hydrochloric Acid SCHEMBL3861515 | 0.76 | HTR2C (0.49) | TLR9TLR8SMN1; SMN2PLATMAPT |
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 |