Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | MIF | P14174 | 1/20 | 0.43 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14938483 | 0.91 | RAB9A (0.56) | ALDH1A1RAB9ANPC1SMN1; SMN2GAA | |
| SCHEMBL14938528 | 0.89 | RAD51 (0.52) | ALDH1A1RAB9AMIFRAD51NPC1 | |
| SCHEMBL14938727 | 0.80 | NPC1 (0.43) | ALDH1A1RAB9ANPC1SMN1; SMN2POLB | |
| SCHEMBL14938449 | 0.80 | HSD17B10 (0.59) | ALDH1A1RAB9ANPC1SMN1; SMN2POLB | |
| SCHEMBL14938600 | 0.80 | SMN1; SMN2 (0.43) | ALDH1A1RAB9ANPC1SMN1; SMN2GAA | |
| SCHEMBL14938561 | 0.80 | ALDH1A1 (0.59) | ALDH1A1MIFSMN1; SMN2MMP2POLB | |
| SCHEMBL14938511 | 0.79 | ALDH1A1 (0.47) | ALDH1A1RAB9ARAD51NPC1SMN1; SMN2 | |
| SCHEMBL28909466 | 0.79 | ALDH1A1 (0.52) | ALDH1A1RAB9AMIFNPC1SMN1; SMN2 | |
| SCHEMBL23253782 | 0.77 | ALDH1A1 (0.60) | ALDH1A1RAB9ANPC1SMN1; SMN2MMP2 | |
| SCHEMBL14950299 | 0.77 | RAB9A (0.49) | ALDH1A1RAB9ARAD51NPC1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| WO-2013067646-A1 | PROCESS FOR THE SYNTHESIS OF BETA-AMINOCARBONYLS | UNIVERSITY OF OTTAWA (CA) | 2013-05-16 | — | — | WO | disclosed |