Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 10/20 | 0.53 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PRPS1 | P60891 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22790044 | 0.88 | NR4A2 (0.51) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL1095771 | 0.84 | NR4A2 (0.52) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL1096569 | 0.84 | NR4A2 (0.52) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL22790300 | 0.82 | NR4A2 (0.47) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL22789981 | 0.79 | NR4A2 (0.49) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL22790043 | 0.77 | SCN9A (0.52) | NR4A2KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL5246371 | 0.76 | NR4A2 (0.65) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL5243737 | 0.74 | NR4A2 (0.63) | NR4A2BRD4KMT2AALDH1A1LMNA | |
| SCHEMBL19202569 | 0.74 | NR4A2 (0.63) | NR4A2BRD4KMT2AMEN1ALDH1A1 | |
| SCHEMBL497718 | 0.74 | NR4A2 (0.63) | NR4A2BRD4KMT2AMEN1ALDH1A1 |
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-2017128896-A1 | FXR AGONIST AND PREPARATION METHOD AND USE THEREOF | 江苏豪森药业集团有限公司 | 2017-08-03 | — | — | WO | disclosed |