Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.30 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL22576579 | 0.80 | ALDH1A1 (0.35) | ALDH1A1MAPTGRM1LMNASLC6A7 | |
| SCHEMBL28494337 | 0.80 | MAP4K4 (0.39) | ALDH1A1MAPTLMNAMAP4K4 | |
| SCHEMBL12465844 | 0.77 | MAPT (0.49) | ALDH1A1MAPTMAPK1POLBTDP1 | |
| SCHEMBL30772278 | 0.77 | MAPT (0.49) | ALDH1A1MAPTMAPK1POLBTDP1 | |
| SCHEMBL27930668 | 0.77 | ALDH1A1 (0.37) | ALDH1A1MAPTMAPK1POLBTDP1 | |
| SCHEMBL12465843 | 0.77 | MAPT (0.49) | ALDH1A1MAPTMAPK1POLBTDP1 | |
| SCHEMBL17461348 | 0.76 | MAPT (0.40) | ALDH1A1MAPTMAPK1POLBTDP1 | |
| SCHEMBL26620008 | 0.74 | MEN1 (0.55) | ALDH1A1MAPTMAPK1POLBL3MBTL1 | |
| SCHEMBL17491561 | 0.73 | LMNA (0.48) | ALDH1A1MAPTMAPK1L3MBTL1LMNA | |
| SCHEMBL17491560 | 0.73 | LMNA (0.48) | ALDH1A1MAPTMAPK1L3MBTL1LMNA |
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-111818924-A | Crystalline salts of B-RAF kinase inhibitors | 徐诺药业公司 | 2020-10-23 | — | — | CN | disclosed |