Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10107970 | 0.81 | ALDH1A1 (0.42) | DRD3ALDH1A1KMT2ATSHR | |
| SCHEMBL10198316 | 0.81 | ALDH1A1 (0.42) | DRD3ALDH1A1KMT2ATSHR | |
| SCHEMBL4711650 | 0.79 | KMT2A (0.37) | ALDH1A1KMT2ATSHRMAPK1 | |
| SCHEMBL4760445 | 0.76 | KMT2A (0.45) | ALDH1A1KMT2ATSHRMAPK1 | |
| SCHEMBL12330520 | 0.70 | CASP3 (0.44) | DRD3ALDH1A1KMT2A | |
| SCHEMBL10107892 | 0.70 | CASP3 (0.44) | DRD3ALDH1A1KMT2A | |
| SCHEMBL18222501 | 0.69 | ALDH1A1 (0.45) | DRD3ALDH1A1KMT2AMAPK1 | |
| SCHEMBL7350766 | 0.69 | ALDH1A1 (0.45) | DRD3ALDH1A1KMT2AMAPK1 | |
| SCHEMBL18658571 | 0.68 | KMT2A (0.44) | DRD3ALDH1A1KMT2ATSHRMAPK1 | |
| SCHEMBL18651719 | 0.66 | KMT2A (0.48) | DRD3ALDH1A1KMT2ATSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1465889-A4 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | ANORMED INC (CA) | 2008-05-14 | — | — | EP | disclosed |
| EP-1465889-A1 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | AnorMED Inc. (CA) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003055876-A1 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | ANORMED INC. (CA) | 2003-07-10 | — | — | WO | disclosed |