Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.51 |
| ▸ | CASP3 | P42574 | 2/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CFTR | P13569 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22116791 | 1.00 | MAPT (0.54) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL15235712 | 0.91 | TSHR (0.46) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL20487128 | 0.85 | MAPT (0.51) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL28345592 | 0.83 | NPC1 (0.59) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL23252136 | 0.82 | ALDH1A1 (0.49) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL1105504 | 0.82 | TSHR (0.67) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL28516020 | 0.82 | PTPN11 (0.51) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL24230149 | 0.82 | ALDH1A1 (0.55) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL28524741 | 0.82 | PTPN11 (0.51) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL29374341 | 0.82 | ALDH1A1 (0.55) | MAPTALDH1A1HSD17B10KDM4EHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115304545-B | Copper-catalyzed selective cyclization of 2-alkynylanilines to quinolines and quinolone derivatives | 湖南大学 | 2023-09-15 | — | — | CN | disclosed |
| CN-115304545-A | Copper-catalyzed selective cyclization of 2-alkynylanilines to quinoline and quinolone derivatives | 湖南大学 | 2022-11-08 | — | — | CN | disclosed |