Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 9/20 | 0.41 |
| ▸ | KIT | P10721 | 7/20 | 0.41 |
| ▸ | FLT3 | P36888 | 7/20 | 0.41 |
| ▸ | LCK | P06239 | 3/20 | 0.41 |
| ▸ | CSF1R | P07333 | 3/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.41 |
| ▸ | PRKACA | P17612 | 3/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.41 |
| ▸ | PLK4 | O00444 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 0.41 |
| ▸ | LYN | P07948 | 2/20 | 0.41 |
| ▸ | MET | P08581 | 2/20 | 0.41 |
| ▸ | SRC | P12931 | 2/20 | 0.41 |
| ▸ | FLT1 | P17948 | 2/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31029238 | 0.89 | KDR (0.41) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29968386 | 0.86 | KDM4E (0.44) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29968009 | 0.83 | EPHX2 (0.42) | KDRKITFLT3CSF1RPRKACA | |
| SCHEMBL29969026 | 0.81 | KDR (0.36) | ACMSDKDRKITFLT3LCK | |
| Methyl Benzoate SCHEMBL31029245 | 0.81 | FLT3 (0.43) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29967799 | 0.81 | KDR (0.41) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29967841 | 0.80 | KDR (0.40) | ACMSDKDRKITFLT3LCK | |
| SCHEMBL29968082 | 0.80 | KDR (0.63) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29967802 | 0.80 | FLT3 (0.43) | KDRKITFLT3LCKCSF1R | |
| SCHEMBL29967788 | 0.79 | KDR (0.41) | KDRKITFLT3LCKCSF1R |
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-115260165-B | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2024-08-06 | — | — | CN | disclosed |
| CN-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |