Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | TNKS | O95271 | 7/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 6/20 | 0.33 |
| ▸ | PARP1 | P09874 | 5/20 | 0.33 |
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.32 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.31 |
| ▸ | TSHR | P16473 | 5/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3846013 | 0.83 | MAPK14 (0.33) | MAPK14CAMKK1CAMKK2CYP3A4HPGD | |
| SCHEMBL3846674 | 0.80 | MAPK14 (0.41) | MAPK14LRRK2 | |
| SCHEMBL3853415 | 0.79 | PIM1 (0.36) | MAPK14TNKSPARP2PARP1CYP3A4 | |
| SCHEMBL3847727 | 0.77 | PIK3CD (0.41) | CYP3A4HPGDCYP1A2TSHRCYP2C19 | |
| SCHEMBL3850684 | 0.76 | ALOX5AP (0.39) | CAMKK1CAMKK2MAPK1MAP4K4 | |
| SCHEMBL3849627 | 0.76 | ALOX5AP (0.35) | — | |
| SCHEMBL3845615 | 0.75 | MAP4K4 (0.33) | CYP3A4HPGDCYP1A2TSHRCYP2C19 | |
| SCHEMBL3847768 | 0.75 | MAP4K4 (0.32) | MAP4K4 | |
| SCHEMBL3846708 | 0.74 | PTGS1 (0.34) | CYP3A4HPGDCYP1A2TSHRCYP2C19 | |
| SCHEMBL3846869 | 0.72 | TGFBR1 (0.35) | MAPK14HPGDCYP1A2CYP2C19MAP4K4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2048142-A2 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | Eisai R&D Management Co., Ltd. (JP) | 2009-04-15 | — | — | EP | disclosed |
| EP-1382603-B1 | NITROGENOUS FUSED-RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF | EISAI R&D MAN CO LTD (JP) | 2008-07-23 | — | — | EP | disclosed |
| US-7074801-B1 | Nitrogen-containing condensed cyclic compound having a pyrazolyl group as a substituent group and pharmaceutical composition thereof | EISAI CO., LTD. (JP) | 2006-07-11 | — | — | US | disclosed |
| EP-1382603-A1 | NITROGENOUS FUSED−RING COMPOUND HAVING PYRAZOLYL GROUP AS SUBSTITUENT AND MEDICINAL COMPOSITION THEREOF | Eisai Co., Ltd. (JP) | 2004-01-21 | — | — | EP | disclosed |