Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ALPL | P05186 | 1/20 | 0.30 |
| ▸ | ALPI | P09923 | 1/20 | 0.30 |
| ▸ | ALPG | P10696 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL19286265 | 0.86 | ALDH1A1 (0.35) | ALDH1A1HTTLMNARECQLNPSR1 | |
| SCHEMBL19286178 | 0.83 | ALDH1A1 (0.35) | ALDH1A1HTTLMNARECQLNPSR1 | |
| SCHEMBL19286275 | 0.80 | MAPT (0.43) | ALDH1A1HTTLMNANPSR1ALOX12 | |
| SCHEMBL19286274 | 0.76 | ALPL (0.31) | ALPLALPIALPG | |
| SCHEMBL19286266 | 0.76 | ALDH1A1 (0.36) | ALDH1A1HTTRECQLALOX12 | |
| SCHEMBL19286250 | 0.75 | HTT (0.40) | ALDH1A1HTTLMNANPC1ALOX12 | |
| SCHEMBL19286301 | 0.75 | HTT (0.40) | ALDH1A1HTTLMNANPC1ALOX12 | |
| SCHEMBL17470113 | 0.75 | ALDH1A1 (0.33) | ALDH1A1HTTNPC1KMT2AMEN1 | |
| SCHEMBL19286203 | 0.73 | MAPT (0.41) | ALDH1A1HTTLMNANPSR1ALOX12 | |
| SCHEMBL19286297 | 0.73 | HTT (0.41) | ALDH1A1HTTLMNANPC1ALOX12 |
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 |