Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1638047 | 0.77 | TAAR1 (0.33) | ADRA2AADRA2BADRA2CCYP2D6TSHR | |
| SCHEMBL1638305 | 0.71 | AAK1 (0.33) | ALDH1A1 | |
| SCHEMBL1637370 | 0.70 | TAAR1 (0.40) | ALDH1A1CYP2D6TSHRTAAR1LMNA | |
| SCHEMBL2693545 | 0.68 | CYP2D6 (0.36) | ADRA2AADRA2BADRA2CCYP2D6TSHR | |
| SCHEMBL7819462 | 0.67 | CYP19A1 (0.39) | ALDH1A1TAAR1LMNASMN1; SMN2 | |
| SCHEMBL1206403 | 0.62 | ALDH1A1 (0.48) | ALDH1A1ADRA2AADRA2BADRA2CSMN1; SMN2 | |
| SCHEMBL4777900 | 0.61 | CXCR4 (0.45) | CYP2D6TSHRTAAR1LMNAGLA | |
| SCHEMBL2127047 | 0.60 | CYP2D6 (0.46) | CYP2D6TSHRTAAR1LMNAGLA | |
| Trityl Imidazole SCHEMBL7622943 | 0.60 | TAAR1 (0.36) | CYP2D6TSHRTAAR1LMNAGLA | |
| SCHEMBL11691018 | 0.60 | KDM4E (0.41) | ALDH1A1ADRA2AADRA2BADRA2CCYP2D6 |
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-1724263-B1 | BASIC AMINE COMPOUND AND USE THEREOF | KUREHA CORP (JP) | 2014-03-05 | — | — | EP | disclosed |
| EP-1724263-A1 | BASIC AMINE COMPOUND AND USE THEREOF | Kureha Corporation (JP) | 2006-11-22 | — | — | EP | disclosed |