Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.31 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19163700 | 0.84 | SMN1; SMN2 (0.38) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL19203603 | 0.83 | SMN1; SMN2 (0.39) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL25789703 | 0.83 | RAPGEF4 (0.38) | RAPGEF4ALDH1A1TDP1 | |
| SCHEMBL17083896 | 0.82 | SMN1; SMN2 (0.37) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL12162725 | 0.81 | SMN1; SMN2 (0.44) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL15417372 | 0.81 | CYP1A2 (0.38) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL12390266 | 0.79 | CYP1A2 (0.37) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL19198900 | 0.79 | SMN1; SMN2 (0.42) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL26627971 | 0.78 | CYP1A2 (0.33) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A | |
| SCHEMBL17083895 | 0.77 | POLB (0.36) | SMN1; SMN2CYP2C9CYP2C19TP53HIF1A |
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-2017132173-A1 | MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE | REGENERON PHARMACEUTICALS, INC. (US) | 2017-08-03 | — | — | WO | disclosed |