Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 8/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18757446 | 1.00 | HTR1B (0.50) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL18728167 | 0.84 | HTR7 (0.43) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL28751083 | 0.84 | CYP1A2 (0.50) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL18728445 | 0.84 | HTR7 (0.43) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL29648252 | 0.84 | HTR7 (0.43) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL29772127 | 0.84 | HTR7 (0.43) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL26636424 | 0.82 | HTR7 (0.42) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL18263398 | 0.81 | HTR1B (0.61) | HTR1BKDM4EMAPTHPGDLMNA | |
| SCHEMBL26636905 | 0.81 | HTR7 (0.44) | HTR1BKDM4EHTR7MAPTL3MBTL1 | |
| SCHEMBL21620925 | 0.80 | HTR7 (0.43) | HTR1BKDM4EHTR7MAPTL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111793077-B | PD-1/PD-L1 small molecule inhibitor and application thereof in medicines | 东莞市东阳光新药研发有限公司 | 2023-08-04 | — | — | CN | disclosed |