Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL25607563 | 1.00 | KMT2A (0.43) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL1135252 | 0.80 | ALDH1A1 (0.48) | KMT2AMEN1LMNAALDH1A1POLB | |
| SCHEMBL22070548 | 0.78 | KMT2A (0.47) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL14677477 | 0.78 | KMT2A (0.47) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL3364540 | 0.77 | KMT2A (0.46) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL5693092 | 0.77 | CHEK1 (0.50) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL14125555 | 0.77 | KMT2A (0.46) | KMT2AMEN1LMNAALDH1A1MAPT | |
| SCHEMBL31638154 | 0.77 | MAPT (0.47) | KMT2AMEN1LMNAMAPTHSD17B10 | |
| SCHEMBL1646319 | 0.77 | MAPT (0.47) | KMT2AMEN1LMNAMAPTHSD17B10 | |
| SCHEMBL29502494 | 0.77 | KMT2A (0.46) | KMT2AMEN1LMNAALDH1A1MAPT |
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-115867553-A | Diaminopyrazolo [1,5-a ] pyrimidine-6-carbonitrile compounds as adenosine 2A receptor and adenosine 2B receptor antagonists | 巴格沃克斯研究有限公司 | 2023-03-28 | — | — | CN | disclosed |