Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1022238 | 1.00 | CYP2D6 (0.42) | CYP2D6CYP3A4CYP1A2TSHRMAPK1 | |
| SCHEMBL6079535 | 0.86 | KMT2A (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 | |
| SCHEMBL943708 | 0.86 | KMT2A (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 | |
| SCHEMBL27156366 | 0.86 | KMT2A (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 | |
| SCHEMBL29819789 | 0.86 | ALDH1A1 (0.50) | CYP3A4CYP1A2TSHRALDH1A1MEN1 | |
| SCHEMBL29820127 | 0.86 | ALDH1A1 (0.50) | CYP3A4CYP1A2TSHRALDH1A1MEN1 | |
| SCHEMBL12480223 | 0.84 | TSHR (0.44) | CYP2D6CYP3A4CYP1A2TSHRALDH1A1 | |
| SCHEMBL2703180 | 0.83 | OPRK1 (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 | |
| SCHEMBL943677 | 0.83 | OPRK1 (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 | |
| SCHEMBL1075333 | 0.83 | OPRK1 (0.43) | CYP2D6ALDH1A1KMT2ACHRM2CHRM4 |
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-2448935-A1 | SUBSTITUTED 2-CARBOXAMIDE CYCLOAMINO UREAS | Novartis AG (CH) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011000905-A1 | SUBSTITUTED 2-CARBOXAMIDE CYCLOAMINO UREAS | NOVARTIS AG (CH) | 2011-01-06 | — | — | WO | disclosed |