Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | CSNK2A2 | P19784 | 4/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 4/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 4/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL16257576 | 0.78 | ANO1 (0.49) | EGFRABCG2KDRAURKAAURKB | |
| SCHEMBL16257589 | 0.76 | CSNK2A2 (0.48) | ALDH1A1KDM4EMEN1GLAHPGD | |
| SCHEMBL12539809 | 0.68 | ADORA3 (0.49) | KDM4ELMNAAURKB | |
| Isophthalic Acid SCHEMBL27798930 | 0.68 | CDC25B (0.44) | ALDH1A1KDM4EMEN1CYP1A2GLA | |
| SCHEMBL18924951 | 0.67 | KMO (0.43) | ALDH1A1KDM4ECYP1A2HPGDCYP2C19 | |
| SCHEMBL15033668 | 0.67 | KMO (0.58) | MEN1KMT2AHSD17B10KMOEGFR | |
| SCHEMBL16257514 | 0.67 | KDM4E (0.46) | KDM4EEGFRMAPK1ABCG2 | |
| SCHEMBL30420994 | 0.66 | ALDH1A1 (0.50) | ALDH1A1KDM4EMEN1CYP1A2GLA | |
| SCHEMBL1202533 | 0.66 | ALDH1A1 (0.50) | ALDH1A1KDM4EMEN1CYP1A2GLA | |
| SCHEMBL16257609 | 0.66 | CSF1R (0.47) | ALDH1A1KDM4EMEN1CYP1A2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-8946218-B2 | CCR2 receptor antagonists, method for producing the same, and use thereof as medicaments | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2015-02-03 | — | — | US | disclosed |
| EP-2569295-B1 | NEW CCR2 RECEPTOR ANTAGONISTS, METHOD FOR PRODUCING THE SAME, AND USE THEREOF AS MEDICAMENTS | BOEHRINGER INGELHEIM INT (DE) | 2014-11-19 | — | — | EP | disclosed |