Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.38 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30623519 | 0.80 | PARP1 (0.34) | MAPTMEN1KMT2APARP1PDPK1 | |
| SCHEMBL7160194 | 0.78 | MAPT (0.38) | MAPTKDM4ETSHRALDH1A1HPGD | |
| SCHEMBL7134588 | 0.77 | TSHR (0.54) | MAPTKDM4ETSHRALDH1A1HPGD | |
| SCHEMBL10917979 | 0.75 | HSPA5 (0.54) | TSHR | |
| SCHEMBL16619753 | 0.75 | GPR84 (0.42) | ALDH1A1PARP1 | |
| SCHEMBL166483 | 0.74 | PARP10 (0.48) | KDM4ETSHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL29818128 | 0.74 | PARP10 (0.48) | KDM4ETSHRALDH1A1HPGDHSD17B10 | |
| SCHEMBL4759339 | 0.74 | PARP1 (0.39) | MAPTKDM4ETSHRALDH1A1HPGD | |
| SCHEMBL7161351 | 0.74 | NPC1 (0.50) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL30839547 | 0.72 | KDM4E (0.38) | MAPTKDM4ETSHRALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005019182-A1 | PYRAZOLYLMETHYLBENZAMIDE DERIVATIVES AS P2XT-RECEPTOR ANTAGONISTS | BAYER HEALTHCARE AG (DE) | 2005-03-03 | — | — | WO | claimed |
| WO-2005019182-A1 | PYRAZOLYLMETHYLBENZAMIDE DERIVATIVES AS P2XT-RECEPTOR ANTAGONISTS | BAYER HEALTHCARE AG (DE) | 2005-03-03 | — | — | WO | disclosed |
| WO-2005019182-A1 | PYRAZOLYLMETHYLBENZAMIDE DERIVATIVES AS P2XT-RECEPTOR ANTAGONISTS | BAYER HEALTHCARE AG (DE) | 2005-03-03 | — | — | WO | disclosed |