Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL15226054 | 1.00 | CA2 (0.54) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL15225887 | 1.00 | CA2 (0.54) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL18395904 | 0.87 | CA2 (0.56) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL6575404 | 0.87 | CA2 (0.56) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL461346 | 0.87 | CA2 (0.56) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL6943821 | 0.87 | CA2 (0.56) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL6943823 | 0.86 | CA2 (0.54) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL18395905 | 0.86 | CA2 (0.54) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL19301013 | 0.84 | CA2 (0.53) | CA2ALDH1A1NPSR1TMEM97SIGMAR1 | |
| SCHEMBL12513225 | 0.84 | CA2 (0.53) | 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 |
|---|---|---|---|---|---|---|---|
| EP-2004667-B1 | NOVEL 11 BETA - HYDROXYANDROSTA-4-ENE-3-ONES | SUN PHARMA ADVANCED RES CO LTD (IN) | 2013-09-04 | — | — | EP | disclosed |