Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL19906174 | 0.89 | NAMPT (0.36) | KDM4EGFERTBXAS1ALDH1A1NAMPT | |
| SCHEMBL15526316 | 0.87 | NAMPT (0.33) | KDM4EGFERTBXAS1ALDH1A1NAMPT | |
| SCHEMBL19906365 | 0.87 | NAMPT (0.38) | KDM4EALDH1A1NAMPTPOLBPTGDR2 | |
| SCHEMBL19906005 | 0.86 | KDM4E (0.39) | KDM4EGFERALDH1A1MAPTPTGDR2 | |
| SCHEMBL19905855 | 0.86 | KDM4E (0.39) | KDM4EALDH1A1MAPTPOLBPTGDR2 | |
| SCHEMBL19905960 | 0.85 | KDM4E (0.42) | KDM4EALDH1A1MAPTPOLBPTGDR2 | |
| SCHEMBL19906299 | 0.83 | KDM4E (0.44) | KDM4EGFERALDH1A1NAMPTMAPT | |
| SCHEMBL15333463 | 0.83 | CYP3A4 (0.39) | KDM4EGFERTBXAS1ALDH1A1NAMPT | |
| SCHEMBL15334233 | 0.83 | CYP3A4 (0.39) | KDM4EGFERTBXAS1ALDH1A1NAMPT | |
| SCHEMBL19906074 | 0.83 | KDM4E (0.38) | KDM4EALDH1A1MAPTPOLBPTGDR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3070081-B1 | BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION | GILEAD SCIENCES INC (US) | 2018-02-28 | — | — | EP | disclosed |