Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | ADK | P55263 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | PDE9A | O76083 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL4034008 | 0.90 | LMNA (0.37) | GSK3BADKTGFBR1LMNAKMT2A | |
| SCHEMBL4035502 | 0.89 | TUBB4A (0.39) | SMN1; SMN2ALDH1A1SLC6A4PTGDR2LMNA | |
| SCHEMBL4035489 | 0.88 | SLC6A4 (0.43) | SMN1; SMN2ALDH1A1GAATGFBR1RAB9A | |
| SCHEMBL4033192 | 0.88 | PKN1 (0.38) | KMT2AMEN1PDE5A | |
| SCHEMBL4043268 | 0.88 | PKN1 (0.36) | SMN1; SMN2TGFBR1RAB9ANPC1MAPT | |
| SCHEMBL4039619 | 0.84 | MAPT (0.46) | SMN1; SMN2ALDH1A1GAARAB9ANPC1 | |
| SCHEMBL4036107 | 0.83 | PDE5A (0.36) | ALDH1A1GSK3BADKTGFBR1HTT | |
| SCHEMBL2053135 | 0.82 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1GAATGFBR1PDE9A | |
| SCHEMBL4036370 | 0.82 | PARP1 (0.37) | ALDH1A1TGFBR1KMT2AMEN1PDE5A | |
| SCHEMBL4036538 | 0.81 | JAK2 (0.48) | ALDH1A1TGFBR1RAB9ANPC1LMNA |
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-1747220-B1 | SUBSTITUTED 1H-PYRROLO[3,2-B, 3,2-C, AND 2,3-C]PYRIDINE-2-CARBOXAMIDES AND RELATED ANALOGS AS INHIBITORS OF CASEIN KINASE I EPSILON | AVENTIS PHARMA INC (US) | 2009-04-15 | — | — | EP | claimed |