Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2014070 | 1.00 | KMT2A (0.40) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL2013850 | 0.80 | NR4A1 (0.42) | KMT2ACYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL2013851 | 0.80 | NR4A1 (0.42) | KMT2ACYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL12631384 | 0.76 | L3MBTL1 (0.50) | KMT2AMEN1LMNATDP1SMN1; SMN2 | |
| SCHEMBL20344487 | 0.75 | ADH1B (0.52) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL7449222 | 0.75 | ADH1B (0.52) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL7449229 | 0.75 | ADH1B (0.52) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL2014206 | 0.73 | ADH1B (0.40) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL20344664 | 0.73 | ADH1B (0.46) | KMT2ACYP1A2CYP2C9CYP2D6TSHR | |
| SCHEMBL19255773 | 0.72 | SMN1; SMN2 (0.48) | KMT2ACYP1A2CYP2C19MEN1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |