Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | RHEB | Q15382 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | USP7 | Q93009 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4035286 | 0.91 | PTPN11 (0.38) | PKMRHEBKDM4ECYP3A4ALOX12 | |
| SCHEMBL4042064 | 0.88 | TGFBR1 (0.38) | PKMRHEBKDM4ECYP3A4ALOX12 | |
| SCHEMBL4033692 | 0.88 | RHEB (0.42) | PKMRHEBMAPTTGFBR1TGFBR2 | |
| SCHEMBL4214923 | 0.87 | ALDH1A1 (0.37) | PKMRHEBKDM4ETDP1PARP1 | |
| SCHEMBL4041978 | 0.86 | CNR2 (0.35) | RHEBKDM4EPARP1MAPTHPGD | |
| SCHEMBL4036107 | 0.86 | PDE5A (0.36) | KDM4ETDP1PARP1HPGDPDE5A | |
| SCHEMBL4041261 | 0.85 | RHEB (0.44) | PKMRHEBKDM4ETDP1PARP1 | |
| SCHEMBL4036172 | 0.84 | PDE5A (0.35) | KDM4EPARP1HPGDPDE5ATGFBR1 | |
| SCHEMBL4036257 | 0.84 | TUBB4A (0.43) | KDM4ECYP3A4PARP1MAPTHPGD | |
| SCHEMBL4038003 | 0.84 | PARP1 (0.39) | KDM4ETDP1PARP1MAPTPDE5A |
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 |