Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 5/20 | 0.34 |
| ▸ | CACNA1I | Q9P0X4 | 5/20 | 0.34 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.32 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.32 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.32 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3440037 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1GABRA1GABRB2MAPT | |
| SCHEMBL15163113 | 0.79 | ALDH1A1 (0.53) | CACNA1GCACNA1ICACNA1HSMN1; SMN2NPC1 | |
| SCHEMBL634112 | 0.77 | GABRA1 (0.33) | GABRA1GABRB2 | |
| SCHEMBL10084656 | 0.76 | ALDH1A1 (0.40) | SMN1; SMN2NPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL15162641 | 0.73 | CACNA1G (0.38) | CACNA1GCACNA1ICACNA1HSMN1; SMN2NPC1 | |
| SCHEMBL2116636 | 0.73 | STIM1 (0.34) | CACNA1GCACNA1ICACNA1HSMN1; SMN2ALDH1A1 | |
| SCHEMBL2113277 | 0.72 | KMT2A (0.43) | CACNA1GCACNA1ICACNA1HSMN1; SMN2NPC1 | |
| SCHEMBL633360 | 0.71 | ALDH1A1 (0.37) | SMN1; SMN2NPC1RAB9AALDH1A1STIM1 | |
| SCHEMBL2113898 | 0.69 | ALDH1A1 (0.39) | NPSR1ALDH1A1GAASTIM1ORAI1 | |
| SCHEMBL3439941 | 0.69 | CACNA1G (0.41) | CACNA1GCACNA1ICACNA1HSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8524750-B2 | (Pyrazol-3-yl)-1,3,4-thiadiazol-2-amine and (pyrazol-3-yl)-1,3,4-thiazol-2-amine compounds | GLAXO GROUP LIMITED (GB) | 2013-09-03 | — | — | US | disclosed |
| EP-2419426-B1 | (PYRAZOL-3-YL)-1,3,4-THIADIAZOL-2-AMINE AND (PYRAZOL-3-YL)-1,3,4-THIAZOL-2-AMINE COMPOUNDS | GLAXO GROUP LTD (GB) | 2013-08-14 | — | — | EP | disclosed |
| WO-2010118852-A1 | ( PYRAZOL-3-YL) -1, 3, 4-THIADIAZOL-2-AMINE AND ( PYRAZOL-3-YL) -1, 3, 4-THIAZOL-2-AMINE COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2010-10-21 | — | — | WO | disclosed |