Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PRNP | P04156 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 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 | |
|---|---|---|---|---|
| SCHEMBL29217847 | 0.79 | CYP1A2 (0.38) | PARP1ARNPSR1HTTLMNA | |
| SCHEMBL1841464 | 0.78 | CALM1 (0.61) | KMT2AMEN1CALM1TSHRHPGD | |
| SCHEMBL21306242 | 0.78 | CALM1 (0.61) | PARP1ARHTTCYP1A2CYP3A4 | |
| SCHEMBL28175543 | 0.78 | KMT2A (0.62) | PARP1ARNPSR1HTTLMNA | |
| SCHEMBL21306300 | 0.76 | CALM1 (0.52) | PARP1ARNPSR1HTTLMNA | |
| SCHEMBL21306246 | 0.75 | CYP2C9 (0.56) | PARP1ARHTTCYP1A2CYP3A4 | |
| SCHEMBL6242217 | 0.72 | KDM4E (0.55) | NPSR1HTTLMNAKMT2AMEN1 | |
| SCHEMBL31682474 | 0.71 | L3MBTL1 (0.60) | NPSR1HTTLMNAPRNPCYP1A2 | |
| SCHEMBL28211667 | 0.71 | L3MBTL1 (0.60) | NPSR1HTTLMNAPRNPCYP1A2 | |
| SCHEMBL28241409 | 0.71 | CYP1A2 (0.47) | PARP1ARNPSR1HTTLMNA |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116376863-A | Plumula Nelumbinis O-methyltransferase and application of encoding gene thereof in biosynthesis of single/double benzyl isoquinoline alkaloid | 中国中医科学院中药研究所 | 2023-07-04 | — | — | CN | disclosed |
| CN-113893248-B | Application of neoliensinine in preparing medicine for treating digestive system tumor | 南京中医药大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-113876774-B | Application of neoliensinine in preparing medicine for treating leukemia | 南京中医药大学 | 2023-03-14 | — | — | CN | disclosed |
| CN-113893248-A | Application of neoliensinine in preparing medicine for treating digestive system tumor | 南京中医药大学 | 2022-01-07 | — | — | CN | disclosed |
| CN-113876774-A | Application of neoliensinine in preparing medicine for treating leukemia | 南京中医药大学 | 2022-01-04 | — | — | CN | disclosed |
| CN-101665460-A | New structural compound neoliensinine and isolation and identification method thereof | NANJING UNIVERSITY OF CHINESE | 2010-03-10 | — | — | CN | disclosed |
| EP-1325915-A1 | Monomeric and dimeric naphtylisoquinoline alkaloids and synthesis methods thereof | THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, Department of Health and Human Services (US) | 2003-07-09 | — | — | EP | disclosed |
| EP-0772595-B1 | MONOMERIC AND DIMERIC NAPHTHYLISOQUINOLINE ALKALOIDS AND SYNTHESIS METHODS THEREOF | US HEALTH (US) | 2003-04-02 | — | — | EP | disclosed |
| US-5763613-A | PARASITICIDES | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1998-06-09 | — | — | US | disclosed |
| EP-0772595-A1 | MONOMERIC AND DIMERIC NAPHTHYLISOQUINOLINE ALKALOIDS AND SYNTHESIS METHODS THEREOF | THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, Department of Health and Human Services (US) | 1997-05-14 | — | — | EP | disclosed |
| US-5552550-A | COUPLING NAPHTHALENE AND ISOQUINOLINE TO FORM ALKALOIDS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1996-09-03 | — | — | US | disclosed |
| WO-1996003382-A1 | MONOMERIC AND DIMERIC NAPHTHYLISOQUINOLINE ALKALOIDS AND SYNTHESIS METHODS THEREOF | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1996-02-08 | — | — | WO | disclosed |