Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14739828 | 0.85 | PDE4D (0.46) | SMN1; SMN2NPC1RAB9AHDAC4HDAC2 | |
| SCHEMBL27724351 | 0.85 | SMN1; SMN2 (0.45) | SMN1; SMN2NPC1RAB9AHDAC4HDAC2 | |
| SCHEMBL995102 | 0.82 | CA1 (0.46) | SMN1; SMN2PDK2ALDH1A1KDM4EMAPT | |
| SCHEMBL30501029 | 0.75 | MEN1 (0.45) | SMN1; SMN2NPC1RAB9APDK2ALDH1A1 | |
| SCHEMBL17853297 | 0.74 | MAPT (0.44) | SMN1; SMN2PDK2ALDH1A1KDM4EMAPT | |
| SCHEMBL14191206 | 0.74 | CA1 (0.50) | SMN1; SMN2PDK2ALDH1A1KDM4EMAPT | |
| SCHEMBL30501017 | 0.72 | PTGS2 (0.42) | SMN1; SMN2NPC1RAB9APDK2ALDH1A1 | |
| SCHEMBL30749099 | 0.71 | PDK2 (0.59) | SMN1; SMN2RAB9APDK2ALDH1A1KDM4E | |
| SCHEMBL16201925 | 0.70 | IDO1 (0.47) | PDK2ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL16674125 | 0.70 | ESR1 (0.51) | SMN1; SMN2RAB9APDK2ALDH1A1KDM4E |
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-2011006574-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2011-01-20 | — | — | WO | disclosed |