Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | CMA1 | P23946 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | LPO | P22079 | 3/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136199 | 0.85 | CCR2 (0.55) | KMT2ASIGMAR1CMA1LPOKDM4E | |
| SCHEMBL3091129 | 0.84 | P2RX4 (0.48) | SIGMAR1CMA1POLBKDM4EALDH1A1 | |
| SCHEMBL1201646 | 0.78 | RECQL (0.44) | KMT2ASIGMAR1CMA1ALDH1A1LMNA | |
| SCHEMBL29136204 | 0.78 | HTT (0.45) | KMT2APOLBALDH1A1LMNAMEN1 | |
| SCHEMBL29136196 | 0.75 | MAPT (0.43) | KMT2ASIGMAR1CMA1POLBKDM4E | |
| SCHEMBL30218812 | 0.75 | KMT2A (0.63) | KMT2ASIGMAR1CMA1POLBLPO | |
| SCHEMBL6087249 | 0.75 | KMT2A (0.63) | KMT2ASIGMAR1CMA1POLBLPO | |
| SCHEMBL3086229 | 0.73 | CYP1A2 (0.39) | POLBKDM4ETP53 | |
| SCHEMBL3079067 | 0.73 | P2RX4 (0.44) | KMT2APOLBKDM4EALDH1A1MAPT | |
| SCHEMBL29136185 | 0.72 | CCR2 (0.52) | KMT2ACMA1POLBKDM4EALDH1A1 |
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-117003739-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 安徽中医药大学 | 2023-11-07 | — | — | CN | disclosed |