Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHKA | P35790 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27947483 | 0.83 | SMN1; SMN2 (0.50) | KDM4ESMN1; SMN2CHRNB2CHRNA4LOXL2 | |
| SCHEMBL30093206 | 0.81 | KDM4E (0.53) | KDM4ESMN1; SMN2CHRNB2CHRNA4LOXL2 | |
| SCHEMBL9281673 | 0.79 | ALDH1A1 (0.54) | KDM4ESMN1; SMN2CYP3A4ALDH1A1PYCR1 | |
| SCHEMBL13683403 | 0.78 | CHRNB2 (0.69) | KDM4ECHRNB2CHRNA4CYP1A2CYP2D6 | |
| SCHEMBL25541294 | 0.78 | KDM4E (0.42) | KDM4ECYP2D6ALDH1A1PYCR1 | |
| SCHEMBL13239689 | 0.77 | ALDH1A1 (0.44) | KDM4ESMN1; SMN2CHRM5CYP1A2CYP3A4 | |
| SCHEMBL733206 | 0.77 | CHRNB2 (0.62) | KDM4ESMN1; SMN2CHRNB2CHRNA4CHRM5 | |
| SCHEMBL25530530 | 0.76 | LMNA (0.51) | CYP1A2CYP2D6CYP2C19PYCR1RAB9A | |
| SCHEMBL24368300 | 0.75 | KDM4E (0.45) | KDM4ESMN1; SMN2CHRNB2CHRNA4LOXL2 | |
| SCHEMBL14432093 | 0.75 | CHRM5 (0.44) | KDM4ESMN1; SMN2CHRNB2CHRNA4LOXL2 |
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-7592373-B2 | Amide compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-09-22 | — | — | US | disclosed |
| US-7592373-B2 | Amide compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-09-22 | — | — | US | disclosed |