Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1656749 | 0.86 | PDE4A (0.50) | PDE4AUSP2SLCO1B1TSHROR51E2 | |
| SCHEMBL396999 | 0.84 | TSHR (0.39) | PDE4AUSP2SLCO1B1TSHRALOX15 | |
| Cadaverine Tartrate SCHEMBL27695422 | 0.84 | PDE4A (0.44) | PDE4AUSP2SLCO1B1TSHROR51E2 | |
| SCHEMBL3289378 | 0.84 | PDE4A (0.48) | PDE4AUSP2SLCO1B1TSHROR51E2 | |
| SCHEMBL16144863 | 0.84 | PDE4A (0.35) | PDE4AUSP2SLCO1B1TSHROR51E2 | |
| Methane SCHEMBL27945359 | 0.83 | TSHR (0.37) | PDE4ATSHRALOX15LMNACHRM2 | |
| SCHEMBL7532569 | 0.83 | TSHR (0.37) | PDE4ATSHRALOX15LMNACHRM2 | |
| Glycerin SCHEMBL6867192 | 0.83 | LMNA (0.39) | PDE4ATSHROR51E2MMP1MMP2 | |
| SCHEMBL17311245 | 0.78 | PDE4A (0.40) | PDE4AUSP2SLCO1B1TSHROR51E2 | |
| SCHEMBL13849512 | 0.78 | TSHR (0.50) | TSHRMMP1MMP2MMP3MMP9 |
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-1993004055-A2 | COMPOUNDS USED FOR THE INHIBITION OF HIV-PROTEASE | THE UPJOHN COMPANY (US) | 1993-03-04 | — | — | WO | disclosed |