Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RORC | P51449 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.44 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30492996 | 0.81 | SMN1; SMN2 (0.68) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL1851780 | 0.81 | SMN1; SMN2 (0.68) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL9525993 | 0.80 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL1545758 | 0.77 | FAAH (0.53) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL9391354 | 0.75 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL5952426 | 0.75 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL4176871 | 0.75 | TDP1 (0.56) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL5783633 | 0.75 | TDP1 (0.53) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL30675569 | 0.74 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 | |
| SCHEMBL10757306 | 0.73 | TDP1 (0.55) | ALDH1A1SMN1; SMN2LMNAMAPK1ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE37729-E1 | 4-Heteroaryl-1-piperidinealkylamines and derivatives thereof and their therapeutic utility | AVENTIS PHARMACEUTICALS INC. | 2002-06-04 | — | — | US | disclosed |