Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL27501908 | 0.83 | PTGDR2 (0.47) | HTTABCB1KMT2AMEN1ALDH1A1 | |
| SCHEMBL27522434 | 0.82 | KDM4E (0.47) | HTTMAPTHPGDALDH1A1LMNA | |
| SCHEMBL65417 | 0.82 | HTR7 (0.44) | MAPTKMT2AMEN1ALDH1A1KDM4E | |
| SCHEMBL1881442 | 0.82 | NR4A2 (0.51) | KMT2AHPGDMEN1ALDH1A1KDM4E | |
| SCHEMBL31688907 | 0.82 | HTT (0.53) | HTTABCB1MAPTKMT2AHPGD | |
| SCHEMBL13153385 | 0.82 | HTT (0.49) | HTTABCB1MAPTKMT2AHPGD | |
| SCHEMBL13335139 | 0.80 | HTT (0.50) | HTTABCB1MAPTKMT2AHPGD | |
| SCHEMBL1077414 | 0.80 | MAPT (0.47) | HTTABCB1MAPTKMT2AHPGD | |
| SCHEMBL9775931 | 0.79 | FGFR1 (0.45) | HTTKMT2AHPGDMEN1ALDH1A1 | |
| SCHEMBL19454487 | 0.79 | ALDH1A1 (0.59) | ABCB1ALDH1A1LMNAKDM4ESCN9A |
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-117285453-A | Method for synthesizing N-substituted-3-methylindole compound by catalyzing nitrogen heterocyclic carbene oxazoline ring palladium compound | 南京林业大学 | 2023-12-26 | — | — | CN | disclosed |