Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MMP1 | P03956 | 3/20 | 0.49 |
| ▸ | MMP2 | P08253 | 3/20 | 0.49 |
| ▸ | MMP9 | P14780 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2854435 | 0.87 | TSHR (0.48) | ALDH1A1LMNAMAPTL3MBTL1HTT | |
| SCHEMBL2858150 | 0.85 | LMNA (0.52) | ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2 | |
| SCHEMBL2861180 | 0.84 | MMP13 (0.46) | ALDH1A1CYP2D6MMP1MMP2MMP9 | |
| SCHEMBL2856255 | 0.84 | GAA (0.48) | ALDH1A1L3MBTL1HTTNPSR1GAA | |
| SCHEMBL2852748 | 0.80 | GRM5 (0.40) | LMNAHPGD | |
| SCHEMBL2849991 | 0.77 | RECQL (0.51) | ALDH1A1LMNAMAPTHTTTSHR | |
| SCHEMBL4073041 | 0.75 | ALDH1A1 (0.62) | ALDH1A1LMNACYP2D6CYP2C19MMP1 | |
| SCHEMBL27839057 | 0.75 | ALDH1A1 (0.62) | ALDH1A1LMNACYP2D6CYP2C19MMP1 | |
| SCHEMBL2851650 | 0.74 | TSHR (0.63) | ALDH1A1LMNACYP2C19L3MBTL1HTT | |
| SCHEMBL1416058 | 0.74 | ALDH1A1 (0.61) | ALDH1A1LMNACYP2D6CYP2C19MMP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1963277-B1 | FLUORINATED COMPOUNDS | NPS PHARMA INC (US) | 2010-01-20 | — | — | EP | claimed |
| US-7902401-B2 | Fluorinated compounds | NPS PHARMACEUTICALS, INC. (US) | 2011-03-08 | — | — | US | disclosed |
| EP-1963277-B1 | FLUORINATED COMPOUNDS | NPS PHARMA INC (US) | 2010-01-20 | — | — | EP | disclosed |