Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 8/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CCR9 | P51686 | 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 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14155126 | 0.84 | CYP11B1 (0.43) | CYP11B2CYP11B1MAPK1 | |
| SCHEMBL14155122 | 0.81 | CYP11B1 (0.37) | KMOCYP11B2CYP11B1POLBKMT2A | |
| SCHEMBL22357749 | 0.66 | HTR2A (0.36) | KMOKMT2AMAPK1 | |
| SCHEMBL21733154 | 0.64 | KMO (0.62) | KMOCYP11B2SMN1; SMN2TSHRMAPK1 | |
| SCHEMBL8253090 | 0.63 | KMO (0.70) | KMOCYP11B2SYKKMT2A | |
| SCHEMBL27605138 | 0.63 | CHEK1 (0.38) | POLBKMT2AALDH1A1HTT | |
| SCHEMBL8430529 | 0.62 | KMO (0.64) | KMOCYP11B2KMT2AALDH1A1CYP1A2 | |
| SCHEMBL17454422 | 0.62 | KMO (0.51) | KMOCYP11B2POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL20665055 | 0.61 | KMO (0.62) | KMOCYP11B2CYP11B1SMN1; SMN2ALDH1A1 | |
| SCHEMBL26622638 | 0.61 | CHEK1 (0.36) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1827427-B1 | ARYLOXYETHYLAMINE DERIVATIVES WITH A COMBINATION OF PARTIAL DOPAMINE-D2 RECEPTOR AGONISM AND SEROTONIN REUPTAKE INHIBITION | SOLVAY PHARM BV (NL) | 2008-07-23 | — | — | EP | disclosed |