Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28923147 | 1.00 | KMT2A (0.42) | KMT2ACYP1A2GAACHRNA7TP53 | |
| SCHEMBL28628118 | 0.85 | KMT2A (0.43) | KMT2ACYP1A2GAAADORA3KDM4E | |
| SCHEMBL30682082 | 0.83 | KMT2A (0.39) | KMT2ACYP1A2GAATP53ADORA3 | |
| SCHEMBL31389863 | 0.78 | ATM (0.43) | KMT2ACYP1A2GAATP53POLB | |
| SCHEMBL19284267 | 0.78 | KMT2A (0.40) | KMT2ACYP1A2GAACHRNA7TP53 | |
| SCHEMBL19299854 | 0.78 | KMT2A (0.40) | KMT2ACYP1A2GAACHRNA7TP53 | |
| SCHEMBL19299890 | 0.78 | KMT2A (0.40) | KMT2ACYP1A2GAACHRNA7TP53 | |
| SCHEMBL31389606 | 0.77 | KMT2A (0.44) | KMT2ACYP1A2GAAKDM4EPOLB | |
| SCHEMBL27152236 | 0.76 | KMT2A (0.46) | KMT2ACYP1A2GAAADORA3KDM4E | |
| SCHEMBL2927030 | 0.73 | CYP1A2 (0.41) | KMT2ACYP1A2GAAADORA3KDM4E |
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-113429410-A | Polyheterocyclic substituted pyrimidine or pyridylamine derivatives, compositions and medical uses thereof | 上海海雁医药科技有限公司 | 2021-09-24 | — | — | CN | disclosed |