Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 4/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.34 |
| ▸ | TGFBR2 | P37173 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL4214923 | 0.87 | ALDH1A1 (0.37) | PARP1PDE5ATGFBR1ALDH1A1MAPT | |
| SCHEMBL4038003 | 0.87 | PARP1 (0.39) | PARP1PDE5ATGFBR1MAPTKDM4E | |
| SCHEMBL4036107 | 0.86 | PDE5A (0.36) | PARP1PDE5ATGFBR1TGFBR2ALDH1A1 | |
| SCHEMBL4034813 | 0.86 | PKM (0.43) | PARP1PDE5ATGFBR1TGFBR2NPC1 | |
| SCHEMBL4041261 | 0.85 | RHEB (0.44) | PARP1NPC1ALDH1A1RAB9ATP53 | |
| SCHEMBL4036257 | 0.84 | TUBB4A (0.43) | PARP1PDE5ATGFBR1NPC1ALDH1A1 | |
| SCHEMBL4036172 | 0.84 | PDE5A (0.35) | PARP1PDE5ATGFBR1TGFBR2ALDH1A1 | |
| SCHEMBL4035502 | 0.83 | TUBB4A (0.39) | PARP1PDE5AALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL4033751 | 0.82 | PTGS2 (0.40) | CNR2PARP1TGFBR1TGFBR2NPC1 | |
| SCHEMBL4033284 | 0.82 | PTGS1 (0.37) | PARP1PDE5ANPC1ALDH1A1RAB9A |
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 |