Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 3/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 1/20 | 0.35 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.35 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| SCHEMBL16169011 | 1.00 | CES2 (0.39) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL5659719 | 0.83 | CES2 (0.44) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL14587412 | 0.83 | CES2 (0.44) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL4337552 | 0.83 | CES2 (0.44) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL1556272 | 0.83 | AKR1C3 (0.43) | AKR1C3AKR1C2RECQLTDP1KDM4E | |
| SCHEMBL1240557 | 0.82 | ADRB2 (0.50) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL1585297 | 0.82 | ADRB2 (0.50) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL7785721 | 0.82 | ADRB2 (0.50) | CES2CES1DPP4ADRB2PDPK1 | |
| SCHEMBL1556537 | 0.82 | APP (0.39) | ADRB2APP | |
| Hydrochloric Acid SCHEMBL4345264 | 0.82 | CES2 (0.43) | CES2CES1DPP4PDPK1AKR1C3 |
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-1694659-B1 | THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS | SCHERING CORP (US) | 2008-08-27 | — | — | EP | disclosed |