Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PDE1A | P54750 | 1/20 | 0.38 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL21362091 | 0.79 | USP2 (0.41) | USP2TSHRALDH1A1KMT2ATDP1 | |
| SCHEMBL252646 | 0.74 | TDP1 (0.34) | PDE5AALDH1A1MEN1HPGDPDE1A | |
| SCHEMBL252645 | 0.74 | TDP1 (0.34) | PDE5AALDH1A1MEN1HPGDPDE1A | |
| SCHEMBL21953526 | 0.68 | NR1H2 (0.50) | ALDH1A1KMT2ATDP1LMNA | |
| SCHEMBL252602 | 0.68 | MAPT (0.35) | ALDH1A1MEN1KMT2ATDP1LMNA | |
| SCHEMBL252601 | 0.68 | MAPT (0.35) | ALDH1A1MEN1KMT2ATDP1LMNA | |
| SCHEMBL20752343 | 0.67 | DNMT1 (0.42) | ALDH1A1TDP1LMNANPC1RAB9A | |
| SCHEMBL252244 | 0.65 | PDE4A (0.39) | USP2TSHRALDH1A1HPGDTDP1 | |
| SCHEMBL2896546 | 0.65 | LMNA (0.41) | USP2TSHRALDH1A1HPGDKMT2A | |
| SCHEMBL14872903 | 0.64 | USP2 (0.43) | USP2TSHRALDH1A1MEN1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| 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 |