Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.46 |
| ▸ | CMA1 | P23946 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LPO | P22079 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL29136185 | 0.88 | CCR2 (0.52) | CCR2CXCR2CMA1MAPTKMT2A | |
| SCHEMBL29136202 | 0.85 | KMT2A (0.55) | SIGMAR1CMA1MAPTTSHRLPO | |
| SCHEMBL29136196 | 0.81 | MAPT (0.43) | CCR2SIGMAR1CMA1MAPTTSHR | |
| SCHEMBL29136172 | 0.80 | CCR2 (0.38) | CCR2SIGMAR1CXCR2MAPTTP53 | |
| SCHEMBL29136176 | 0.80 | IDO1 (0.47) | CCR2TSHRKMT2AMEN1ALDH1A1 | |
| SCHEMBL29136194 | 0.77 | SLC6A2 (0.42) | MAPTTSHRKMT2ALMNATP53 | |
| SCHEMBL29136197 | 0.76 | KDM4E (0.44) | MAPTTSHRKMT2ALMNAALDH1A1 | |
| SCHEMBL29136191 | 0.75 | MAPT (0.40) | CCR2MAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL29136213 | 0.73 | CCR2 (0.51) | CCR2SIGMAR1CXCR2CMA1MAPT | |
| SCHEMBL17187081 | 0.73 | HTR2A (0.37) | CCR2MAPTKMT2ALMNATP53 |
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 |