Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.34 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL185524 | 0.81 | MAP2K4 (0.39) | ALDH1A1JAK2JAK1MAP2K1KDM4E | |
| SCHEMBL1980737 | 0.78 | SCN9A (0.41) | ALDH1A1P2RX4NPC1RAB9ASCN9A | |
| SCHEMBL187085 | 0.75 | CCR4 (0.41) | — | |
| SCHEMBL11752453 | 0.69 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4EMEN1HPGD | |
| SCHEMBL1855369 | 0.68 | SCN9A (0.45) | ALDH1A1P2RX4NPC1RAB9ASCN9A | |
| SCHEMBL18953224 | 0.68 | ELANE (0.56) | ALDH1A1P2RX4SCN9A | |
| SCHEMBL17311564 | 0.67 | ELANE (0.50) | P2RX4 | |
| SCHEMBL11747221 | 0.67 | MAP2K4 (0.44) | SCN9ACACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL11755492 | 0.66 | TSHR (0.40) | ALDH1A1SCN9ATSHRKDM4EHPGD | |
| SCHEMBL20867976 | 0.65 | ALDH1A1 (0.56) | ALDH1A1NPC1RAB9ATSHRKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2401270-A1 | PYRAZOLE DERIVATIVES USED AS CCR4 RECEPTOR ANTAGONISTS | Glaxo Group Limited (GB) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097395-A1 | PYRAZOLE DERIVATIVES USED AS CCR4 RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2010-09-02 | — | — | WO | disclosed |