Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 4/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | C1S | P09871 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 4/20 | 0.32 |
| ▸ | PLAT | P00750 | 2/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.32 |
| ▸ | F7 | P08709 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 2/20 | 0.32 |
| ▸ | F10 | P00742 | 2/20 | 0.32 |
| ▸ | PLG | P00747 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL2477674 | 0.78 | KDM4E (0.50) | PRSS1PRSS2PRSS3CA1CA2 | |
| SCHEMBL31324841 | 0.78 | KDM4E (0.50) | PRSS1PRSS2PRSS3CA1CA2 | |
| SCHEMBL17730530 | 0.74 | PRSS1 (0.42) | PRSS1PRSS2PRSS3C1SKDM4E | |
| SCHEMBL15483655 | 0.73 | ALDH1A1 (0.40) | CA1CA2MAPTGAAKDM4E | |
| SCHEMBL820013 | 0.73 | PRSS1 (0.40) | PRSS1PRSS2PRSS3C1SMAPT | |
| SCHEMBL68382 | 0.72 | CA1 (0.56) | CA1CA2MAPTGAAKDM4E | |
| SCHEMBL4126506 | 0.71 | HMGB1 (0.57) | MAPTGAAKDM4EALDH1A1MEN1 | |
| SCHEMBL30931541 | 0.71 | MEN1 (0.42) | CA1CA2MAPTGAAKDM4E | |
| SCHEMBL30931542 | 0.71 | MEN1 (0.42) | CA1CA2MAPTGAAKDM4E | |
| SCHEMBL27752442 | 0.70 | PRSS1 (0.58) | PRSS1PRSS2PRSS3CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101146529-B | Novel thiophene derivatives as sphingosine-1-phosphate-1 receptor agonists | ACTELION PHARMACEUTICALS LTD | 2012-08-29 | — | — | CN | disclosed |
| CN-101146529-A | Novel thiophene derivatives as sphingosine-1-phosphate-1 receptor agonists | ACTELION PHARMACEUTICALS LTD (CH) | 2008-03-19 | — | — | CN | disclosed |