Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL7784073 | 0.96 | — | — | |
| SCHEMBL27810445 | 0.82 | — | — | |
| Alcohol SCHEMBL28208224 | 0.74 | CRBN (0.39) | LMNACRBNTAS2R38 | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL29156088 | 0.74 | CYP1A2 (0.39) | KDM4ECA2ALDH1A1LMNA | |
| SCHEMBL1298104 | 0.71 | — | — | |
| SCHEMBL9834752 | 0.71 | — | — | |
| SCHEMBL9392436 | 0.69 | — | — | |
| SCHEMBL11582029 | 0.69 | — | — | |
| SCHEMBL9319664 | 0.69 | — | — | |
| SCHEMBL28414458 | 0.69 | — | — |
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-109988124-A | A kind of inhibitor of the kidney type glutaminase allosteric site of diazole containing oxygen group elements or tetrazole structure | 杭州健昵福生物科技有限公司 | 2019-07-09 | — | — | CN | disclosed |