Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19286264 | 0.86 | ALDH1A1 (0.36) | ALDH1A1HTTLMNARECQLNPSR1 | |
| SCHEMBL19286179 | 0.84 | ALDH1A1 (0.34) | ALDH1A1HTTNPC1 | |
| SCHEMBL19286273 | 0.84 | ALDH1A1 (0.34) | ALDH1A1HTTNPC1 | |
| SCHEMBL19286275 | 0.78 | MAPT (0.43) | ALDH1A1HTTLMNANPSR1POLB | |
| SCHEMBL17470121 | 0.77 | ALDH1A1 (0.33) | ALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL17470109 | 0.77 | ALDH1A1 (0.33) | ALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL19286266 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HTTRECQLALOX12 | |
| SCHEMBL19286250 | 0.73 | HTT (0.40) | ALDH1A1HTTLMNANPC1MAPT | |
| SCHEMBL19286301 | 0.73 | HTT (0.40) | ALDH1A1HTTLMNANPC1MAPT | |
| SCHEMBL19286274 | 0.73 | ALPL (0.31) | — |
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-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |