Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7707666 | 0.77 | PTPN5 (0.43) | PTPN5NPSR1HTR2CHTR2BHTR2A | |
| SCHEMBL16105091 | 0.73 | — | — | |
| SCHEMBL8995621 | 0.73 | CES2 (0.31) | CES2 | |
| SCHEMBL11287914 | 0.72 | NOTUM (0.43) | HTR2CCES2NOTUMTSHR | |
| SCHEMBL8104090 | 0.71 | P2RX7 (0.41) | P2RX7ARPTPN5HTR2CHTR2B | |
| SCHEMBL7705238 | 0.71 | KIF11 (0.44) | CES2TSHRALDH1A1 | |
| SCHEMBL7705819 | 0.70 | CFTR (0.38) | ARNPSR1HPGDTSHRALDH1A1 | |
| SCHEMBL24910289 | 0.69 | P2RX7 (0.39) | P2RX7ARPTPN5NPSR1HTR2C | |
| SCHEMBL7702031 | 0.69 | AR (0.41) | ARPTPN5CES2CA1CA2 | |
| SCHEMBL7705830 | 0.69 | GAA (0.39) | ARNOTUMLMNACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6060569-A | USING AS COORDINATION CATALYSTS NOVEL NICKEL COMPLEXES IN WHICH THE NICKEL IS COORDINATED TO SELECTED PHOSPHOROUS SUBSTITUTED ARYL SULFONAMIDE LIGANDS; LUBRICANTS OR IN WAXES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-05-09 | — | — | US | disclosed |