Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPOX | P50336 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8848996 | 0.84 | TAAR1 (0.47) | PPOXKDM4EALDH1A1LMNAPOLB | |
| SCHEMBL18038554 | 0.81 | LMNA (0.38) | PPOXKDM4ERORCALDH1A1L3MBTL1 | |
| SCHEMBL19088271 | 0.77 | PPOX (0.46) | PPOXKDM4ECYP1A2CYP2C19RORC | |
| SCHEMBL12486984 | 0.76 | KDM1A (0.36) | ALDH1A1 | |
| SCHEMBL19088273 | 0.76 | PPOX (0.45) | PPOXKDM4ECYP1A2CYP2C19RORC | |
| SCHEMBL6830840 | 0.75 | PTPN1 (0.34) | KDM4E | |
| SCHEMBL30902485 | 0.74 | LMNA (0.47) | PPOXKDM4ECYP1A2CYP2C19RORC | |
| SCHEMBL7003415 | 0.73 | MTNR1A (0.44) | KDM4EALDH1A1POLB | |
| SCHEMBL16200095 | 0.73 | KDM4E (0.46) | PPOXKDM4ECYP1A2CYP2C19RORC | |
| SCHEMBL9851159 | 0.73 | PPOX (0.37) | PPOXKDM4ECYP1A2CYP2C19RORC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0772579-A1 | BENZOYL DERIVATIVES AND SYNTHESIS THEREOF | MONSANTO COMPANY (US) | 1997-05-14 | — | — | EP | disclosed |
| WO-1996002485-A1 | BENZOYL DERIVATIVES AND SYNTHESIS THEREOF | MONSANTO COMPANY (US) | 1996-02-01 | — | — | WO | disclosed |