Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 8/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 5/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | CTSG | P08311 | 1/20 | 0.42 |
| ▸ | KLK7 | P49862 | 1/20 | 0.42 |
| ▸ | KLK14 | Q9P0G3 | 1/20 | 0.42 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13234529 | 0.90 | KCNH2 (0.51) | MTNR1AMTNR1BKDM4EALDH1A1HPGD | |
| SCHEMBL19579751 | 0.88 | ALOX15 (0.55) | PDE3BPDE3AMTNR1AMTNR1BKDM4E | |
| SCHEMBL8353954 | 0.88 | PDE3B (0.60) | PDE3BPDE3AKDM4EALDH1A1DYRK1A | |
| SCHEMBL31389238 | 0.83 | ALOX15 (0.57) | KDM4EPLA2G2A | |
| SCHEMBL562343 | 0.80 | BACE1 (0.47) | PDE3BPDE3AKDM4EALDH1A1HPGD | |
| SCHEMBL16832599 | 0.80 | PLA2G2A (0.54) | PDE3BKDM4EALDH1A1HPGDDYRK1A | |
| SCHEMBL1896519 | 0.79 | PDE3B (0.50) | PDE3BPDE3ABACE1 | |
| SCHEMBL9384011 | 0.77 | ALOX15 (0.53) | PDE3BPDE3AKDM4EALDH1A1HPGD | |
| SCHEMBL20952122 | 0.77 | ALDH1A1 (0.58) | KDM4EALDH1A1HPGDGAA | |
| SCHEMBL4620316 | 0.77 | PLA2G2A (0.47) | KDM4EPLA2G2A |
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-2003053349-A2 | INHIBITORS OF HEPATITIS C VIRUS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-07-03 | — | — | WO | disclosed |