Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 8/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | BCL6 | P41182 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MPI | P34949 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23884979 | 0.80 | JAK3 (0.33) | ERN1ALDH1A1GAA | |
| SCHEMBL7996324 | 0.75 | CYP3A4 (0.42) | ERN1ALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL29411195 | 0.74 | TDP1 (0.45) | ERN1ALDH1A1KDM4ENPC1CYP1A2 | |
| SCHEMBL899188 | 0.74 | TDP1 (0.45) | ERN1ALDH1A1KDM4ENPC1CYP1A2 | |
| SCHEMBL25523961 | 0.74 | MAPT (0.35) | ALDH1A1KDM4EGAACYP1A2CYP3A4 | |
| SCHEMBL2490048 | 0.74 | ALDH1A1 (0.32) | ERN1ALDH1A1KMT2A | |
| SCHEMBL1553383 | 0.73 | ALDH1A1 (0.38) | ERN1ALDH1A1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL16187962 | 0.72 | S1PR2 (0.38) | S1PR2EDNRAALDH1A1GAANPC1 | |
| SCHEMBL502070 | 0.72 | ERN1 (0.33) | ERN1ALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL31139452 | 0.72 | ERN1 (0.33) | ERN1ALDH1A1KDM4ECYP1A2CYP3A4 |
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-2012044567-A2 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |