Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 4/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL943677 | 1.00 | OPRK1 (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL2703180 | 1.00 | OPRK1 (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL27156366 | 0.88 | KMT2A (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL943708 | 0.88 | KMT2A (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL6079535 | 0.88 | KMT2A (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL1022236 | 0.83 | CYP2D6 (0.42) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL1022238 | 0.83 | CYP2D6 (0.42) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL1055995 | 0.82 | KMT2A (0.43) | OPRK1OPRM1OPRD1OPRL1KMT2A | |
| SCHEMBL29819789 | 0.80 | ALDH1A1 (0.50) | KMT2AKDM4ECHRM2CHRM1ALDH1A1 | |
| SCHEMBL29820127 | 0.80 | ALDH1A1 (0.50) | KMT2AKDM4ECHRM2CHRM1ALDH1A1 |
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-2448946-A1 | 2-CARBOXAMIDE CYCLOAMINO UREAS USEFUL AS PI3K INHIBITORS | Novartis AG (CH) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011000855-A1 | 2-CARBOXAMIDE CYCLOAMINO UREAS USEFUL AS PI3K INHIBITORS | NOVARTIS AG (CH) | 2011-01-06 | — | — | WO | disclosed |