Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968287 | 1.00 | LMNA (0.53) | LMNAMAPTKDM4EHTTMEN1 | |
| SCHEMBL28871280 | 0.88 | KDR (0.44) | LMNAMAPTKDM4EHTTMEN1 | |
| SCHEMBL29967967 | 0.88 | KDR (0.44) | LMNAMAPTKDM4EHTTMEN1 | |
| SCHEMBL28871215 | 0.87 | ALDH1A1 (0.49) | MAPTKDM4EHTTMEN1KMT2A | |
| SCHEMBL29968067 | 0.87 | ALDH1A1 (0.49) | MAPTKDM4EHTTMEN1KMT2A | |
| SCHEMBL29968276 | 0.83 | KDR (0.41) | MEN1KMT2ANPC1RAB9A | |
| SCHEMBL28871209 | 0.83 | KDR (0.41) | MEN1KMT2ANPC1RAB9A | |
| SCHEMBL29968066 | 0.83 | MAPK1 (0.41) | MEN1KMT2ANPC1RAB9AMAPK1 | |
| SCHEMBL28871289 | 0.83 | MAPK1 (0.41) | MEN1KMT2ANPC1RAB9AMAPK1 | |
| SCHEMBL28871310 | 0.81 | KCNH2 (0.48) | PLK1 |
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-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |