Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Chavicol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.50 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PPARD | Q03181 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Chavicol SCHEMBL10525947 | 0.92 | XDH (0.47) | CA2XDHCAMK2AALDH1A1KDM4E | |
| Chavicol SCHEMBL7209702 | 0.92 | CYP1A2 (0.47) | CA2XDHCAMK2AALDH1A1KDM4E | |
| Chavicol SCHEMBL3871465 | 0.91 | XDH (0.54) | CA2XDHCAMK2AALDH1A1KDM4E | |
| Chavicol SCHEMBL30870 | 0.91 | XDH (0.58) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL11043594 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL7187339 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL7924978 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL10565597 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL10511637 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 | |
| Chavicol SCHEMBL5483528 | 0.89 | XDH (0.56) | CA2XDHALDH1A1KDM4EMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010018177-A1 | REACTION PRODUCTS OF OXAZOLIDINE DERIVATIVES AND OF BISOXAZOLIDINE DERIVATIVES, IN PARTICULAR WITH DERIVATIVES OF HYDROXYAROMATICS AND OF NITROGEN-CONTAINING COMPOUNDS, SUCH AS AMINOTRIAZINES | BOREALIS AGROLINZ MELAMINE GMBH (AT) | 2010-02-18 | — | — | WO | disclosed |
| EP-1456296-A1 | ADDITIVE FOR INHIBITING PHOTOLYTIC DEGRADATION REACTIONS IN AMINOPLASTS | AMI Agrolinz Melamine International GmbH (AT) | 2004-09-15 | — | — | EP | disclosed |
| WO-2003054083-A1 | ADDITIVE FOR INHIBITING PHOTOLYTIC DEGRADATION REACTIONS IN AMINOPLASTS | AMI - AGROLINZ MELAMINE INTERNATIONAL GMBH (AT) | 2003-07-03 | — | — | WO | disclosed |