Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 8/20 | 0.53 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.43 |
| ▸ | SGK1 | O00141 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | AKT2 | P31751 | 1/20 | 0.42 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.42 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL45469 | 0.82 | KDM4E (0.67) | KDM4EMAPTHDAC8SMYD3 | |
| SCHEMBL45245 | 0.78 | KDM4E (0.65) | KDM4EMAPTHDAC8SMYD3 | |
| SCHEMBL16061494 | 0.74 | KDM4E (0.59) | KDM4EMAPTHDAC8SMYD3 | |
| SCHEMBL15616643 | 0.73 | ALDH1A1 (0.47) | RORCKDM4EMAPT | |
| SCHEMBL15616410 | 0.72 | RORC (0.89) | RORC | |
| SCHEMBL45293 | 0.72 | KDM4E (0.62) | KDM4EMAPTHDAC8SMYD3 | |
| SCHEMBL15616523 | 0.72 | PPARG (0.51) | MAPT | |
| SCHEMBL3200151 | 0.71 | NPC1 (0.68) | MAPK14KDM4EMAPTRIPK2SMYD3 | |
| SCHEMBL3211244 | 0.69 | MAPK14 (0.62) | MAPK14RORCRIPK2SMYD3 | |
| SCHEMBL1232193 | 0.69 | MAPK14 (1.00) | MAPK14RAF1CYP1A2CYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014008214-A1 | BIARYL-CONTAINING COMPOUNDS AS INVERSE AGONISTS OF ROR-GAMMA RECEPTORS | BIOGEN IDEC MA INC. (US) | 2014-01-09 | — | — | WO | disclosed |