Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | WDR5 | P61964 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2824030 | 0.99 | NPC1 (0.40) | NPC1RAB9ASMN1; SMN2MAPTPKM | |
| SCHEMBL2822113 | 0.85 | ALDH1A1 (0.43) | NPC1RAB9ASMN1; SMN2MAPTPKM | |
| Hydrochloric Acid SCHEMBL2822814 | 0.84 | ALDH1A1 (0.42) | NPC1RAB9ASMN1; SMN2MAPTPKM | |
| SCHEMBL668390 | 0.83 | ACHE (0.36) | NPC1RAB9ASMN1; SMN2MAPTPKM | |
| SCHEMBL4469713 | 0.81 | RXFP1 (0.41) | NPC1RAB9ASMN1; SMN2MAPTWDR5 | |
| SCHEMBL2820263 | 0.80 | SLC6A2 (0.31) | — | |
| Bromide SCHEMBL4480044 | 0.80 | RXFP1 (0.40) | NPC1RAB9ASMN1; SMN2MAPTWDR5 | |
| Hydrochloric Acid SCHEMBL2823335 | 0.79 | SLC6A2 (0.30) | — | |
| SCHEMBL2819737 | 0.78 | SCD (0.35) | — | |
| SCHEMBL2819424 | 0.78 | KCNH2 (0.36) | SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1922320-B1 | DERIVATIVES OF 5-PYRIDAZINYL-1-AZABICYCLO[3.2.1]OCTANE, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS | SANOFI AVENTIS (FR) | 2010-10-27 | — | — | EP | claimed |