Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL22221069 | 0.73 | NISCH (0.44) | NISCHMTNR1ALTA4HPOLBESR2 | |
| SCHEMBL28894086 | 0.68 | POLB (0.46) | NISCHMTNR1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3809469 | 0.68 | POLB (0.46) | NISCHMTNR1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL266615 | 0.67 | NISCH (0.48) | NISCHMTNR1ALTA4HPOLBESR2 | |
| SCHEMBL12401665 | 0.67 | NISCH (0.48) | NISCHMTNR1ALTA4HPOLBESR2 | |
| SCHEMBL963837 | 0.67 | NISCH (0.53) | NISCHMTNR1ALTA4HSMN1; SMN2POLB | |
| SCHEMBL8347684 | 0.67 | NISCH (0.48) | NISCHMTNR1ALTA4HPOLBESR2 | |
| SCHEMBL14543303 | 0.67 | NISCH (0.48) | NISCHMTNR1ALTA4HPOLBESR2 | |
| SCHEMBL13923633 | 0.67 | RAB9A (0.65) | NPC1RAB9AL3MBTL1NPSR1POLB | |
| SCHEMBL28170425 | 0.65 | NISCH (0.40) | NISCHSMN1; SMN2LMNAMAPTHPGD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111960970-B | Antitumor compounds | 中国人民解放军总医院 | 2021-08-20 | — | — | CN | disclosed |
| CN-108997172-B | Antitumor compounds | 中国人民解放军总医院 | 2020-12-15 | — | — | CN | disclosed |
| CN-111960970-A | Antitumor compounds | 中国人民解放军总医院 | 2020-11-20 | — | — | CN | disclosed |
| CN-111960985-A | Antitumor compounds | 中国人民解放军总医院 | 2020-11-20 | — | — | CN | disclosed |
| CN-111892516-A | Antitumor compounds | 中国人民解放军总医院 | 2020-11-06 | — | — | CN | disclosed |
| CN-111892517-A | Antitumor compounds | 中国人民解放军总医院 | 2020-11-06 | — | — | CN | disclosed |