Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.56 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 2/20 | 0.50 |
| ▸ | DHFR | P00374 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | ADCY10 | Q96PN6 | 6/20 | 0.48 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718901 | 0.86 | HSP90AB1 (0.74) | HSP90AB1HSP90AA1KDM4ESMN1; SMN2ADCY10 | |
| SCHEMBL28845377 | 0.82 | NOS1 (0.53) | BACE1DHFRKCNH2NOS1CYP2D6 | |
| SCHEMBL5674666 | 0.82 | KCNH2 (0.52) | SMN1; SMN2BACE1KCNH2NOS1 | |
| SCHEMBL30509728 | 0.79 | BACE1 (0.51) | KDM4EBACE1DHFRKCNH2NOS1 | |
| SCHEMBL13153731 | 0.79 | NOS1 (0.51) | KDM4EBACE1DHFRKCNH2NOS1 | |
| SCHEMBL1998718 | 0.79 | HSP90AB1 (0.51) | HSP90AB1HSP90AA1KDM4ESMN1; SMN2DHFR | |
| SCHEMBL28335587 | 0.76 | SMN1; SMN2 (0.63) | HSP90AB1HSP90AA1KDM4ESMN1; SMN2DHFR | |
| SCHEMBL4639838 | 0.75 | PRMT6 (0.45) | HSP90AB1HSP90AA1KDM4EBACE1 | |
| SCHEMBL12122637 | 0.74 | SMN1; SMN2 (0.74) | HSP90AB1HSP90AA1KDM4ESMN1; SMN2HRH4 | |
| SCHEMBL5745860 | 0.74 | HSP90AB1 (0.53) | HSP90AB1HSP90AA1KDM4ESMN1; SMN2BACE1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010120854-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-10-21 | — | — | WO | disclosed |
| WO-2010120854-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2010-10-21 | — | — | WO | disclosed |