Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 3/20 | 0.59 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.59 |
| ▸ | STIM1 | Q13586 | 5/20 | 0.56 |
| ▸ | ORAI1 | Q96D31 | 5/20 | 0.56 |
| ▸ | OGT | O15294 | 1/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.53 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.53 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | LDHA | P00338 | 2/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29626830 | 1.00 | KEAP1 (0.59) | KEAP1NFE2L2STIM1ORAI1OGT | |
| SCHEMBL26628305 | 0.86 | KEAP1 (0.69) | KEAP1NFE2L2STIM1ORAI1OGT | |
| SCHEMBL29946136 | 0.86 | KEAP1 (0.69) | KEAP1NFE2L2STIM1ORAI1OGT | |
| SCHEMBL1427395 | 0.82 | STIM1 (0.66) | KEAP1NFE2L2STIM1ORAI1HSD17B1 | |
| SCHEMBL30932256 | 0.80 | P2RY14 (0.53) | KEAP1NFE2L2STIM1ORAI1OGT | |
| SCHEMBL29946256 | 0.79 | STIM1 (0.63) | KEAP1NFE2L2STIM1ORAI1HSD17B1 | |
| SCHEMBL1429925 | 0.79 | STIM1 (0.64) | KEAP1NFE2L2STIM1ORAI1HSD17B1 | |
| SCHEMBL1430338 | 0.79 | STIM1 (0.63) | KEAP1NFE2L2STIM1ORAI1HSD17B1 | |
| SCHEMBL2711661 | 0.79 | STIM1 (0.67) | KEAP1NFE2L2STIM1ORAI1HSD17B1 | |
| SCHEMBL1429953 | 0.79 | STIM1 (0.62) | KEAP1NFE2L2STIM1ORAI1HSD17B1 |
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-114450271-A | Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition | 纽力克斯治疗公司 | 2022-05-06 | — | — | CN | disclosed |