Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 4/20 | 0.38 |
| ▸ | RHEB | Q15382 | 2/20 | 0.36 |
| ▸ | USP7 | Q93009 | 2/20 | 0.35 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.33 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | PRF1 | P14222 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | PTGDR | Q13258 | 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 | |
|---|---|---|---|---|
| SCHEMBL4034813 | 0.91 | PKM (0.43) | RHEBUSP7KDM4ECYP3A4ALOX12 | |
| SCHEMBL4041261 | 0.85 | RHEB (0.44) | RHEBKDM4ETDP1PKMPARP1 | |
| SCHEMBL4033692 | 0.84 | RHEB (0.42) | RHEBUSP7USP47PKMMAPT | |
| SCHEMBL4042064 | 0.84 | TGFBR1 (0.38) | RHEBKDM4ECYP3A4ALOX12TDP1 | |
| SCHEMBL4214923 | 0.83 | ALDH1A1 (0.37) | RHEBKDM4ETDP1PKMPARP1 | |
| SCHEMBL4032842 | 0.83 | PARP1 (0.40) | PTPN11RHEBUSP7USP47PKM | |
| SCHEMBL4036107 | 0.82 | PDE5A (0.36) | KDM4ETDP1PARP1HPGDTGFBR1 | |
| SCHEMBL4041978 | 0.82 | CNR2 (0.35) | RHEBKDM4EPARP1MAPTHPGD | |
| SCHEMBL4035489 | 0.81 | SLC6A4 (0.43) | RHEBKDM4ECYP3A4PARP1HPGD | |
| SCHEMBL4036257 | 0.80 | TUBB4A (0.43) | KDM4ECYP3A4PARP1MAPTHPGD |
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 |