Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | GPR6 | P46095 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL2930746 | 0.90 | ACHE (0.40) | ALDH1A1GPR6OGAADORA2AADORA1 | |
| SCHEMBL2930557 | 0.89 | HTT (0.38) | ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL1761069 | 0.89 | FAAH (0.42) | KDM4EALDH1A1TSHRMEN1ALOX15 | |
| SCHEMBL2930809 | 0.88 | LMNA (0.40) | KDM4EALDH1A1MEN1MAPK1KMT2A | |
| SCHEMBL2930497 | 0.88 | GPR6 (0.35) | KDM4ESMN1; SMN2GPR6EPHX2ADORA3 | |
| SCHEMBL3049811 | 0.86 | MEN1 (0.42) | ALDH1A1TSHRMEN1MAPK1KMT2A | |
| SCHEMBL2930508 | 0.86 | GPR6 (0.34) | SMN1; SMN2GPR6ADORA3ADORA2AADORA1 | |
| SCHEMBL3050426 | 0.85 | BCHE (0.42) | TSHRMEN1KMT2ASMN1; SMN2GPR6 | |
| SCHEMBL2929411 | 0.84 | ADORA2A (0.41) | KDM4EALDH1A1TSHRMEN1MAPK1 | |
| SCHEMBL2934358 | 0.84 | ACHE (0.41) | KDM4EALDH1A1 |
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-2027132-B1 | THIAZOLO-PYRAMIDINE / PYRIDINE UREA DERIVATIVES AS ADENOSINE A2B RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-09-15 | — | — | EP | claimed |