Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CKS1B | P61024 | 1/20 | 0.34 |
| ▸ | SKP1 | P63208 | 1/20 | 0.34 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786909 | 0.89 | MET (0.39) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4742621 | 0.87 | USP2 (0.45) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4742105 | 0.84 | THRB (0.45) | PTPN11METMAPTSMN1; SMN2RXFP1 | |
| SCHEMBL4743444 | 0.80 | USP2 (0.54) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4743037 | 0.79 | MAPT (0.40) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4785451 | 0.77 | MAPK1 (0.72) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4743406 | 0.77 | MET (0.39) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4743466 | 0.75 | THRB (0.46) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4743456 | 0.70 | MAPT (0.47) | USP2TP53MAPK1RECQLHSD17B10 | |
| SCHEMBL4785479 | 0.70 | THRB (0.42) | PTPN11METMAPTLMNACKS1B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008093940-A1 | QUINOLINE DERIVATIVES AS CASPASE-3 INHIBITOR, PREPARATION PROCESS FOR THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | YUNGJIN PHARMACEUTICAL CO., LTD. (KR) | 2008-08-07 | — | — | WO | disclosed |