Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | CHKA | P35790 | 3/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2201868 | 0.95 | ALDH1A1 (0.51) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL27363365 | 0.93 | ALDH1A1 (0.53) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL27659481 | 0.91 | ALDH1A1 (0.55) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL9658891 | 0.85 | SLC2A1 (0.49) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL9030925 | 0.84 | ALDH1A1 (0.50) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL5232980 | 0.83 | ADRB1 (0.55) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL9094196 | 0.83 | SLC2A1 (0.67) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL17319560 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL10473803 | 0.82 | MEN1 (0.56) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 | |
| SCHEMBL16633168 | 0.81 | ALDH1A1 (0.55) | ALDH1A1ALOX15HSD17B10MAPTL3MBTL1 |
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-116332929-A | 3-amido-beta-carboline compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-06-27 | — | — | CN | disclosed |