Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 8/20 | 0.47 |
| ▸ | BCR | P11274 | 8/20 | 0.47 |
| ▸ | KDR | P35968 | 9/20 | 0.41 |
| ▸ | KIT | P10721 | 8/20 | 0.41 |
| ▸ | FLT3 | P36888 | 8/20 | 0.41 |
| ▸ | CXCR5 | P32302 | 2/20 | 0.39 |
| ▸ | LCK | P06239 | 3/20 | 0.37 |
| ▸ | CSF1R | P07333 | 3/20 | 0.37 |
| ▸ | FLT1 | P17948 | 3/20 | 0.37 |
| ▸ | FLT4 | P35916 | 3/20 | 0.37 |
| ▸ | LYN | P07948 | 2/20 | 0.37 |
| ▸ | SRC | P12931 | 2/20 | 0.37 |
| ▸ | BLK | P51451 | 2/20 | 0.37 |
| ▸ | PLK4 | O00444 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | INSR | P06213 | 2/20 | 0.37 |
| ▸ | MET | P08581 | 2/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968386 | 0.82 | KDM4E (0.44) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL31029238 | 0.79 | KDR (0.41) | ABL1BCRKDRKITFLT3 | |
| Methyl Benzoate SCHEMBL31029245 | 0.79 | FLT3 (0.43) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29967890 | 0.78 | ACMSD (0.42) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29968009 | 0.73 | EPHX2 (0.42) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29967618 | 0.73 | ABL1 (0.36) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29967964 | 0.72 | KDR (0.44) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29967563 | 0.72 | KDR (0.48) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29968082 | 0.71 | KDR (0.63) | ABL1BCRKDRKITFLT3 | |
| SCHEMBL29967799 | 0.69 | KDR (0.41) | ABL1BCRKDRKITFLT3 |
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-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 |