Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2013851 | 1.00 | NR4A1 (0.42) | NR4A1CRHBPCRHR2CYP1A2CYP2C19 | |
| SCHEMBL2014070 | 0.80 | KMT2A (0.40) | CYP1A2CYP2C19ALDH1A1KDM4EHPGD | |
| SCHEMBL2014073 | 0.80 | KMT2A (0.40) | CYP1A2CYP2C19ALDH1A1KDM4EHPGD | |
| SCHEMBL12630471 | 0.73 | NR4A1 (0.42) | NR4A1CRHBPCRHR2CYP1A2CYP2C19 | |
| Nitric Acid SCHEMBL29049200 | 0.66 | MAPT (0.55) | CRHBPCRHR2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL9864607 | 0.66 | ESR1 (0.52) | CYP1A2ALDH1A1KDM4EHPGDCYP3A4 | |
| SCHEMBL8176357 | 0.64 | HSD17B10 (0.50) | CYP1A2CYP2C19ALDH1A1KDM4EHPGD | |
| SCHEMBL2014206 | 0.64 | ADH1B (0.40) | CRHBPCRHR2CYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL3468225 | 0.64 | SMN1; SMN2 (0.51) | CRHBPCRHR2CYP1A2ALDH1A1KDM4E | |
| Benzil SCHEMBL10476771 | 0.64 | CES2 (0.54) | CYP1A2ALDH1A1KDM4EHPGDCYP3A4 |
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-2011070069-A1 | PROCESS FOR PREPARATION OF MEDETOMIDINE | I-TECH AB (SE) | 2011-06-16 | — | — | WO | claimed |
| WO-2011070069-A1 | PROCESS FOR PREPARATION OF MEDETOMIDINE | I-TECH AB (SE) | 2011-06-16 | — | — | WO | disclosed |
| WO-2011070069-A1 | PROCESS FOR PREPARATION OF MEDETOMIDINE | I-TECH AB (SE) | 2011-06-16 | — | — | WO | disclosed |