Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | ALPG | P10696 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157556 | 0.88 | LMNA (0.44) | LMNASMN1; SMN2ALDH1A1ALPGTDP1 | |
| SCHEMBL21362519 | 0.85 | KMT2A (0.44) | SMN1; SMN2HPGDKMT2AMEN1 | |
| SCHEMBL20158052 | 0.85 | LMNA (0.39) | LMNASMN1; SMN2ALDH1A1ALPGTDP1 | |
| SCHEMBL21564971 | 0.81 | CES2 (0.34) | SMN1; SMN2ALDH1A1HPGDHTTKMT2A | |
| SCHEMBL11860220 | 0.81 | LTA4H (0.46) | LMNASMN1; SMN2ALDH1A1ALPGHPGD | |
| SCHEMBL20157488 | 0.80 | HTT (0.49) | LMNASMN1; SMN2ALDH1A1TDP1HPGD | |
| SCHEMBL20157547 | 0.78 | MAPT (0.50) | LMNASMN1; SMN2ALDH1A1TDP1HTT | |
| SCHEMBL21351930 | 0.78 | LMNA (0.39) | LMNASMN1; SMN2ALDH1A1ALPGTDP1 | |
| SCHEMBL21362658 | 0.77 | AAK1 (0.35) | LMNASMN1; SMN2ALDH1A1ALPGTDP1 | |
| SCHEMBL21362792 | 0.76 | ALDH1A1 (0.44) | ALDH1A1HPGDHTTNPSR1NPC1 |
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 |