Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | FABP2 | P12104 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3917123 | 1.00 | PARP1 (0.42) | PARP1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL13840626 | 0.89 | PARP1 (0.41) | PARP1NPC1RAB9AMAPTGAA | |
| SCHEMBL3925046 | 0.89 | PARP1 (0.41) | PARP1NPC1RAB9AMAPTGAA | |
| SCHEMBL4385667 | 0.88 | ADRB2 (0.45) | PARP1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL4385662 | 0.88 | ADRB2 (0.45) | PARP1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL13840696 | 0.85 | NPC1 (0.47) | PARP1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL3917066 | 0.85 | NPC1 (0.47) | PARP1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL3913906 | 0.84 | ADRB2 (0.47) | RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL13840617 | 0.84 | ADRB2 (0.47) | RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL13840627 | 0.84 | ADRB2 (0.39) | — |
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-7538141-B2 | Compounds for the treatment of diseases | PFIZER INC. | 2009-05-26 | — | — | US | disclosed |