Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.34 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.31 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.31 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL8890374 | 0.90 | CCR5 (0.36) | CCR5MBTD1L3MBTL3L3MBTL1NAMPT | |
| SCHEMBL8892523 | 0.83 | NPY2R (0.36) | CCR5MBTD1L3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL8890322 | 0.82 | NAMPT (0.33) | CCR5NAMPTPDE2ATAS1R3TAS1R1 | |
| SCHEMBL8890658 | 0.82 | PTGS2 (0.40) | CCR5MBTD1L3MBTL3L3MBTL1ALDH1A1 | |
| SCHEMBL8489230 | 0.82 | DHODH (0.38) | NAMPTPDE2ADHODH | |
| SCHEMBL8893223 | 0.82 | NAMPT (0.32) | CCR5NAMPTPDE2ATAS1R3TAS1R1 | |
| SCHEMBL8889700 | 0.81 | TSHR (0.42) | CCR5DHODHALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL8892076 | 0.81 | KDM4E (0.34) | NAMPTPDE2ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL8890001 | 0.81 | KDM4E (0.36) | NAMPTALDH1A1CYP3A4MAPTCYP2C9 | |
| SCHEMBL8891694 | 0.81 | CCR5 (0.35) | CCR5MBTD1L3MBTL3L3MBTL1TAS1R3 |
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-1997028136-A1 | BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES | RHONE-POULENC AGRICULTURE LTD. (GB) | 1997-08-07 | — | — | WO | disclosed |