Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12163921 | 1.00 | TMEM97 (0.38) | TMEM97SIGMAR1CA2ALDH1A1NPSR1 | |
| SCHEMBL12163768 | 1.00 | TMEM97 (0.38) | TMEM97SIGMAR1CA2ALDH1A1NPSR1 | |
| SCHEMBL16358110 | 0.92 | TMEM97 (0.37) | TMEM97SIGMAR1CA2ALDH1A1NPSR1 | |
| SCHEMBL2462990 | 0.85 | TMEM97 (0.43) | TMEM97SIGMAR1CA2ALDH1A1NPSR1 | |
| SCHEMBL4637754 | 0.80 | TMEM97 (0.51) | TMEM97SIGMAR1MEN1CYP3A4KMT2A | |
| SCHEMBL2075913 | 0.80 | TMEM97 (0.51) | TMEM97SIGMAR1MEN1CYP3A4KMT2A | |
| SCHEMBL1133835 | 0.80 | ALDH1A1 (0.43) | CA2ALDH1A1NPSR1HPGDKDM4E | |
| SCHEMBL1133834 | 0.80 | ALDH1A1 (0.43) | CA2ALDH1A1NPSR1HPGDKDM4E | |
| SCHEMBL17968478 | 0.78 | TMEM97 (0.42) | TMEM97SIGMAR1CA2ALDH1A1NPSR1 | |
| SCHEMBL7165644 | 0.78 | ALDH1A1 (0.45) | CA2ALDH1A1NPSR1HPGDKDM4E |
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-2010072315-A1 | AMINO ACID ESTER PRODRUGS AND THE USE THEREOF | BAYER SCHERING PHARMA AG (DE) | 2010-07-01 | — | — | WO | disclosed |