Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157286 | 0.86 | KDM4E (0.45) | KDM4EALDH1A1HSD17B10HPGDCYP2C9 | |
| SCHEMBL2774909 | 0.71 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10HPGDCYP2C9 | |
| SCHEMBL20157812 | 0.71 | BRD4 (0.35) | KDM4EALDH1A1HSD17B10HPGDCYP2C9 | |
| SCHEMBL20157786 | 0.70 | KDM4E (0.48) | KDM4EALDH1A1HSD17B10HPGDCYP2C9 | |
| SCHEMBL7678852 | 0.70 | LMNA (0.51) | KDM4EALDH1A1HPGDKMT2AMAPT | |
| SCHEMBL2773038 | 0.70 | KDM4E (0.39) | KDM4EALDH1A1HSD17B10HPGDCYP2C9 | |
| SCHEMBL25664507 | 0.69 | GAA (0.57) | KDM4EALDH1A1HSD17B10KMT2AL3MBTL1 | |
| SCHEMBL7678717 | 0.67 | LMNA (0.57) | KDM4EMAPTPOLBL3MBTL1SMN1; SMN2 | |
| SCHEMBL2167305 | 0.65 | NLRP3 (0.51) | KDM4EALDH1A1HSD17B10KMT2AMAPT | |
| SCHEMBL2167246 | 0.65 | NLRP3 (0.51) | KDM4EALDH1A1HSD17B10HPGDKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3539960-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) | 2019-09-18 | — | — | EP | disclosed |
| WO-2018086605-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |