Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK1D | P48730 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | FOS | P01100 | 1/20 | 0.43 |
| ▸ | JUN | P05412 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12279519 | 1.00 | CSNK1D (0.45) | CSNK1DALDH1A1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL31019262 | 0.87 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2NFKB1NFKB2RELA | |
| SCHEMBL2324922 | 0.87 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2NFKB1NFKB2RELA | |
| SCHEMBL2324613 | 0.87 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2NFKB1NFKB2RELA | |
| SCHEMBL26645844 | 0.80 | KDM4E (0.52) | ALDH1A1HSP90AA1HSD17B10KDM4ERAB9A | |
| SCHEMBL16654595 | 0.79 | ALDH1A1 (0.41) | CSNK1DALDH1A1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL16651064 | 0.78 | ALDH1A1 (0.45) | CSNK1DALDH1A1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL16651065 | 0.78 | ALDH1A1 (0.45) | CSNK1DALDH1A1SMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL29635234 | 0.78 | KDM4E (0.53) | ALDH1A1SMN1; SMN2HSD17B10KDM4EMAPT | |
| SCHEMBL26659825 | 0.77 | CYP2C9 (0.43) | ALDH1A1SMN1; SMN2HSD17B10KDM4ERAB9A |
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-110563722-A | pyridine or pyridazine ring compound and application thereof | 上海青煜医药科技有限公司 | 2019-12-13 | — | — | CN | disclosed |