Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.65 |
| ▸ | CHUK | O15111 | 1/20 | 0.65 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.64 |
| ▸ | NPC1 | O15118 | 3/20 | 0.64 |
| ▸ | RAB9A | P51151 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | RELA | Q04206 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 6/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | GLA | P06280 | 2/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL258432 | 1.00 | IKBKB (0.65) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL719584 | 0.86 | KDM4E (0.58) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL2896095 | 0.86 | IKBKB (0.68) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL16475087 | 0.84 | KDM4E (0.57) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL1266041 | 0.83 | KDM4E (0.56) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL22638989 | 0.82 | IKBKB (0.63) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL9541091 | 0.82 | IKBKB (0.63) | IKBKBCHUKLIMK1KDM4EMAPT | |
| SCHEMBL29707339 | 0.81 | KDM4E (0.70) | IKBKBLIMK1KDM4EMAPTNPC1 | |
| SCHEMBL3494383 | 0.81 | KDM4E (0.70) | IKBKBLIMK1KDM4EMAPTNPC1 | |
| SCHEMBL16475088 | 0.80 | KDM4E (0.61) | IKBKBCHUKLIMK1KDM4EMAPT |
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-115988685-A | Synthesis method of halogen substituted thienopyridine compound | 烟台宁远药业有限公司 | 2023-04-18 | — | — | CN | disclosed |