Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.44 |
| ▸ | HPGD | P15428 | 7/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1940252 | 0.93 | KDM4E (0.44) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1938842 | 0.90 | KDM4E (0.42) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1939290 | 0.90 | KMT2A (0.42) | KDM4EALDH1A1HSD17B10CASP1POLB | |
| SCHEMBL1940984 | 0.90 | KDM4E (0.42) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1941404 | 0.89 | KDM4E (0.42) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1940392 | 0.89 | KDM4E (0.41) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1938601 | 0.88 | ALDH1A1 (0.46) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1937952 | 0.88 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1938605 | 0.88 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL1938636 | 0.88 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10HPGDTSHR |
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-1851225-B1 | PYRAZOLO-PYRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2011-06-15 | — | — | EP | claimed |