Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28480405 | 0.95 | — | — | |
| SCHEMBL26978255 | 0.81 | KMT2A (0.33) | KMT2AHCAR2TSHRGAAALDH1A1 | |
| SCHEMBL31736856 | 0.78 | CXCR4 (0.32) | — | |
| SCHEMBL3801455 | 0.77 | ALDH1A1 (0.40) | KMT2ATSHRGAAALDH1A1POLB | |
| SCHEMBL6382528 | 0.74 | ALDH1A1 (0.34) | KMT2AALDH1A1POLBMAPTL3MBTL1 | |
| SCHEMBL29777610 | 0.74 | KDM4E (0.35) | KMT2AALDH1A1POLBMAPTTDP1 | |
| SCHEMBL6384570 | 0.73 | ALDH1A1 (0.36) | ALDH1A1POLBMAPT | |
| SCHEMBL29852457 | 0.73 | ALDH1A1 (0.44) | KMT2AGAAALDH1A1POLBMAPT | |
| SCHEMBL31336737 | 0.72 | GABRA1 (0.35) | KMT2A | |
| SCHEMBL6382734 | 0.69 | GAA (0.33) | KMT2AGAAALDH1A1MAPTTDP1 |
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-109715632-B | Macrocyclic indole derivatives | 拜尔公开股份有限公司 | 2021-10-26 | — | — | CN | disclosed |