Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 9/20 | 1.00 |
| ▸ | XPNPEP2 | O43895 | 2/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | PEPD | P12955 | 2/20 | 0.36 |
| ▸ | XPNPEP1 | Q9NQW7 | 1/20 | 0.36 |
| ▸ | REN | P00797 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17339958 | 0.90 | ACE (1.00) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL17339960 | 0.85 | ACE (0.75) | ACEXPNPEP2HSD17B10PEPDXPNPEP1 | |
| SCHEMBL17339961 | 0.77 | ACE (0.74) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL17339959 | 0.68 | ACE (0.61) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL6679097 | 0.63 | DPP4 (0.58) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL6679094 | 0.63 | DPP4 (0.58) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL5963563 | 0.62 | HSD17B10 (0.53) | ACEXPNPEP2HSD17B10LMNASMN1; SMN2 | |
| SCHEMBL26213401 | 0.61 | PTPN1 (0.49) | ACEXPNPEP2HSD17B10KDM4ELMNA | |
| SCHEMBL20375838 | 0.60 | ACE (0.51) | ACEXPNPEP2HSD17B10PEPDREN | |
| SCHEMBL10795143 | 0.60 | ACE (0.89) | ACEHSD17B10PEPDRENKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016085530-A1 | 4-FLUORO-THIO-CONTAINING INHIBITORS OF APP2, COMPOSITIONS THEREOF AND METHOD OF USE | SIMMONS WILLIAM H (US) | 2016-06-02 | — | — | WO | disclosed |
| US-9212206-B1 | 4-Fluoro-Thio-containing inhibitors of APP2, compositions thereof and method of use | SIMMONS WILLIAM H (US) | 2015-12-15 | — | — | US | disclosed |
| US-9212206-B1 | 4-Fluoro-Thio-containing inhibitors of APP2, compositions thereof and method of use | SIMMONS WILLIAM H (US) | 2015-12-15 | — | — | US | disclosed |