Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL8510244 | 0.86 | LMNA (0.39) | PTGDR2LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL8515160 | 0.86 | PTGDR2 (0.51) | PTGDR2LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL30597890 | 0.81 | RXRA (0.49) | PTGDR2LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL1293281 | 0.81 | RXRA (0.49) | PTGDR2LMNASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL4820133 | 0.80 | PTGDR2 (0.45) | PTGDR2LMNASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL17703261 | 0.76 | PTGDR2 (0.42) | PTGDR2LMNASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL2284093 | 0.76 | ALDH1A1 (0.43) | LMNASMN1; SMN2ALDH1A1POLBMAPT | |
| SCHEMBL1330449 | 0.74 | SLC6A4 (0.49) | LMNASMN1; SMN2ALDH1A1POLBMAPT | |
| SCHEMBL9259271 | 0.74 | MAPK1 (0.58) | LMNASMN1; SMN2ALDH1A1POLBMAPT | |
| SCHEMBL7847441 | 0.73 | PTGDR2 (0.40) | PTGDR2ALDH1A1HTTRAB9ANPC1 |
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-2012069852-A1 | PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF SPHINGOSINE KINASE | ALMAC DISCOVERY LIMITED (GB) | 2012-05-31 | — | — | WO | disclosed |