Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | FSHR | P23945 | 1/20 | 0.37 |
| ▸ | APLNR | P35414 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.36 |
| ▸ | RELA | Q04206 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28976941 | 0.84 | TSHR (0.35) | GAATSHRFSHRAPLNRNFKB1 | |
| SCHEMBL28269461 | 0.79 | GAA (0.39) | GAATSHRFSHRAPLNRNFKB1 | |
| SCHEMBL1656241 | 0.78 | NFKB1 (0.41) | GAATDP1NFKB1NFKB2RELA | |
| SCHEMBL573575 | 0.75 | NFKB1 (0.39) | GAATDP1NFKB1NFKB2RELA | |
| SCHEMBL1829582 | 0.75 | CYP17A1 (0.39) | GAATDP1NFKB1NFKB2RELA | |
| SCHEMBL4603098 | 0.73 | GAA (0.39) | GAANFKB1NFKB2RELACA1 | |
| SCHEMBL3344623 | 0.71 | GAA (0.36) | GAATSHRFSHRNFKB1NFKB2 | |
| SCHEMBL1551115 | 0.69 | ALDH1A1 (0.40) | GAANFKB1NFKB2RELACA1 | |
| SCHEMBL29791359 | 0.67 | PSMB8 (0.47) | CA1 | |
| SCHEMBL8007325 | 0.67 | MEN1 (0.40) | GAAAPLNRTDP1NFKB1NFKB2 |
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-107141293-A | Nitrogen-containing heterocyclic compound, preparation method, intermediate, composition and application | 上海医药集团股份有限公司 | 2017-09-08 | — | — | CN | disclosed |