Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10314726 | 0.84 | CTDSP1 (0.45) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL1859536 | 0.84 | CTDSP1 (0.45) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL10314728 | 0.84 | CTDSP1 (0.45) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL8257934 | 0.79 | CTDSP1 (0.41) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL16448090 | 0.78 | TMEM97 (0.45) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL16448088 | 0.78 | TMEM97 (0.45) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL4132454 | 0.76 | CA2 (0.50) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| Ethyl Acetate SCHEMBL8723173 | 0.76 | ALDH1A1 (0.45) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL13651150 | 0.76 | CA2 (0.50) | CA2ALDH1A1NPSR1CTDSP1TMEM97 | |
| SCHEMBL17038984 | 0.76 | CA2 (0.47) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 |
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-2015018333-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) | 2015-02-12 | — | — | WO | disclosed |