Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL847829 | 0.86 | HDAC1 (0.48) | HDAC1ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL6237639 | 0.85 | ALDH1A1 (0.57) | HDAC1ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL5808011 | 0.78 | TSHR (0.48) | HDAC1ALDH1A1LMNATSHRSMN1; SMN2 | |
| SCHEMBL3974811 | 0.78 | MAPKAPK2 (0.48) | HDAC1ALDH1A1LMNANPC1RAB9A | |
| SCHEMBL2556067 | 0.77 | MAPT (0.50) | HDAC1ALDH1A1LMNAMEN1MAPT | |
| SCHEMBL3977167 | 0.77 | MAPKAPK2 (0.50) | ALDH1A1LMNANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL15738567 | 0.76 | FAAH (0.53) | — | |
| SCHEMBL19748921 | 0.75 | HDAC1 (0.43) | HDAC1ALDH1A1LMNATSHRSMN1; SMN2 | |
| SCHEMBL31225844 | 0.74 | NPC1 (0.41) | HDAC1EPHX2ALDH1A1LMNANPC1 | |
| SCHEMBL991807 | 0.74 | CASP1 (0.53) | HDAC1EPHX2ALDH1A1TSHRSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010097395-A1 | PYRAZOLE DERIVATIVES USED AS CCR4 RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2010-09-02 | — | — | WO | disclosed |