Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 8/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28468875 | 0.88 | POLB (0.68) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL7976334 | 0.84 | KMT2A (0.64) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL2454762 | 0.84 | KMT2A (0.59) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL9779998 | 0.84 | MAPT (0.59) | HTTPOLBCYP1A2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL5122021 | 0.82 | MAPT (0.57) | HTTPOLBCYP1A2KMT2AMEN1 | |
| SCHEMBL30352517 | 0.81 | LMNA (0.56) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL11244747 | 0.80 | CA12 (0.60) | LMNAPOLBCYP1A2KMT2AMEN1 | |
| SCHEMBL21980929 | 0.80 | POLB (0.58) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL27890896 | 0.80 | LMNA (0.54) | HTTLMNAPOLBCYP1A2KMT2A | |
| SCHEMBL6630458 | 0.80 | RAB9A (0.65) | KMT2AMEN1ALDH1A1MAPTGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112125824-B | Synthetic method of alpha-cyanoglycine compound | 西北师范大学（CN） | 2023-01-13 | — | — | CN | disclosed |
| CN-112125824-A | Synthetic method of alpha-cyanoglycine compound | 西北师范大学 | 2020-12-25 | — | — | CN | disclosed |