Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | DCTPP1 | Q9H773 | 2/20 | 0.42 |
| ▸ | CCR2 | P41597 | 2/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29136197 | 0.92 | KDM4E (0.44) | MAPTKMT2AALDH1A1KDM4EPTGS2 | |
| SCHEMBL29136185 | 0.90 | CCR2 (0.52) | MAPTKMT2AALDH1A1KDM4EALOX15 | |
| SCHEMBL3091129 | 0.85 | P2RX4 (0.48) | MAPTALDH1A1KDM4EALOX15CMA1 | |
| SCHEMBL28415278 | 0.81 | DCTPP1 (0.41) | MAPTKMT2AALDH1A1KDM4EALOX15 | |
| SCHEMBL29136199 | 0.81 | CCR2 (0.55) | MAPTKMT2AALDH1A1KDM4ECMA1 | |
| SCHEMBL29136202 | 0.75 | KMT2A (0.55) | MAPTKMT2AALDH1A1KDM4ECMA1 | |
| SCHEMBL29136172 | 0.74 | CCR2 (0.38) | MAPTALDH1A1KDM4ECCR2PTGS2 | |
| SCHEMBL539086 | 0.74 | ALDH1A1 (0.45) | MAPTKMT2AALDH1A1KDM4EPOLB | |
| SCHEMBL29136191 | 0.70 | MAPT (0.40) | MAPTKMT2AALDH1A1CCR2PTGS2 | |
| SCHEMBL28979220 | 0.69 | PDE5A (0.62) | MAPTKMT2AALDH1A1KDM4EALOX15 |
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 |