Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | FLT1 | P17948 | 1/20 | 0.43 |
| ▸ | FLT4 | P35916 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.40 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL8629389 | 0.90 | ERBB2 (0.45) | ERBB2HSP90AA1HSP90AB1FLT1FLT4 | |
| SCHEMBL8634775 | 0.87 | NAT1 (0.50) | ERBB2HSP90AA1HSP90AB1KDRPOLB | |
| SCHEMBL8627973 | 0.83 | KDM1A (0.51) | KDRPOLBNPSR1KDM4ERXFP1 | |
| SCHEMBL8631659 | 0.82 | NAT1 (0.53) | ERBB2HSP90AA1HSP90AB1NPSR1KDM4E | |
| SCHEMBL8631080 | 0.80 | KMO (0.52) | PTGES2NPSR1KDM4ERXFP1PGR | |
| SCHEMBL8758268 | 0.80 | PKM (0.42) | ERBB2HSP90AA1HSP90AB1PTGES2POLB | |
| SCHEMBL8632286 | 0.78 | KIT (0.45) | KDRNPSR1KDM4ERXFP1PGR | |
| SCHEMBL8627985 | 0.78 | FFAR4 (0.50) | POLBKDM4EALDH1A1SMN1; SMN2AVPR2 | |
| SCHEMBL8631173 | 0.77 | POLB (0.43) | POLBNPSR1KDM4ERXFP1ALDH1A1 | |
| SCHEMBL8629394 | 0.76 | KDM4E (0.40) | KDRNPSR1KDM4ERXFP1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |