Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | CTSB | P07858 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | IDE | P14735 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.48 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13241732 | 0.84 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL1475834 | 0.83 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL29525309 | 0.83 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL16166514 | 0.81 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL28049064 | 0.81 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL28049120 | 0.80 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL31574149 | 0.80 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL31574161 | 0.80 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL13369816 | 0.79 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2CTSBHTTLMNA | |
| SCHEMBL16167173 | 0.78 | NPC1 (0.56) | ALDH1A1SMN1; SMN2HTTLMNAMAPT |
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-2010034740-A1 | (R)-3-(N,N-DIMETHYLAMINO)PYRROLIDINE DERIVATIVES | PALAU PHARMA, S.A. (ES) | 2010-04-01 | — | — | WO | disclosed |