Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 5/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | CBFB | Q13951 | 1/20 | 0.33 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.33 |
| ▸ | REN | P00797 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
| ▸ | SELE | P16581 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | ADK | P55263 | 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) | PDE5ATGFBR1PARP1JAK2ALDH1A1 | |
| SCHEMBL4036257 | 0.87 | TUBB4A (0.43) | PDE5AADORA2ATGFBR1PARP1JAK2 | |
| SCHEMBL4036172 | 0.87 | PDE5A (0.35) | PDE5ATGFBR1PARP1JAK2CBFB | |
| SCHEMBL4034813 | 0.86 | PKM (0.43) | PDE5ATGFBR1PARP1ALDH1A1KDM4E | |
| SCHEMBL4041978 | 0.86 | CNR2 (0.35) | PDE5ATGFBR1PARP1JAK2ALDH1A1 | |
| SCHEMBL4041261 | 0.85 | RHEB (0.44) | PARP1ALDH1A1KDM4ETP53HPGD | |
| SCHEMBL4038003 | 0.84 | PARP1 (0.39) | PDE5ATGFBR1PARP1ICAM1KDM4E | |
| SCHEMBL4035502 | 0.83 | TUBB4A (0.39) | PDE5APARP1JAK2ALDH1A1KMT2A | |
| SCHEMBL4032967 | 0.83 | SMN1; SMN2 (0.41) | PDE5ATGFBR1ALDH1A1TP53HPGD | |
| SCHEMBL4033284 | 0.82 | PTGS1 (0.37) | PDE5APARP1JAK2ALDH1A1ICAM1 |
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 |