Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8890001 | 0.91 | KDM4E (0.36) | KDM4EALDH1A1HPGDNAMPTCYP3A4 | |
| SCHEMBL8890374 | 0.90 | CCR5 (0.36) | ALDH1A1NAMPTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8890580 | 0.86 | HSP90AA1 (0.33) | NAMPTHSP90AA1PDE2ANPC1RAB9A | |
| SCHEMBL8488431 | 0.86 | DHODH (0.34) | NAMPTPDE2ADHODHEPHX2 | |
| SCHEMBL8892076 | 0.85 | KDM4E (0.34) | KDM4EALDH1A1HPGDNAMPTPDE2A | |
| SCHEMBL8889606 | 0.85 | TSHR (0.34) | KDM4EALDH1A1NAMPTCYP1A2CYP3A4 | |
| SCHEMBL27295039 | 0.84 | DHODH (0.33) | NAMPTPDE2ADHODHEPHX2 | |
| SCHEMBL8489456 | 0.84 | DHODH (0.34) | ALDH1A1HPGDNAMPTPDE2ADHODH | |
| SCHEMBL8891685 | 0.84 | PTGS2 (0.38) | MEN1KMT2A | |
| SCHEMBL8815393 | 0.83 | EPHX2 (0.31) | NAMPTPDE2ADHODHEPHX2 |
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 |