Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10401158 | 0.86 | ALDH1A1 (0.53) | ALDH1A1MAPTGAARAB9ASMN1; SMN2 | |
| SCHEMBL10335011 | 0.85 | MEN1 (0.57) | ALDH1A1GAACYP3A4CYP2D6POLB | |
| SCHEMBL17787758 | 0.79 | ALDH1A1 (0.59) | ALDH1A1MAPTGAARAB9ASMN1; SMN2 | |
| SCHEMBL4275831 | 0.78 | NPC1 (0.71) | ALDH1A1CYP3A4CYP2D6KMT2ANPC1 | |
| SCHEMBL8213090 | 0.78 | CACNA2D1 (0.53) | ALDH1A1GAACYP3A4NPC1MAPK1 | |
| SCHEMBL2794421 | 0.78 | CACNA2D1 (0.66) | ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL2792145 | 0.78 | CACNA2D1 (0.48) | ALDH1A1L3MBTL1POLBTDP1 | |
| SCHEMBL10401479 | 0.77 | ALDH1A1 (0.59) | ALDH1A1MAPTGAARAB9ASMN1; SMN2 | |
| SCHEMBL5065803 | 0.77 | LMNA (0.58) | ALDH1A1RAB9ASMN1; SMN2CYP2D6HTT | |
| Oxalic Acid SCHEMBL10401502 | 0.76 | SLC18A3 (0.61) | SLC18A3 |
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-4957927-A | (Diarylmethoxy alkyl)-1-pyrrolidines and piperidines having cardiovascular activity | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1990-09-18 | — | — | US | disclosed |