Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 6/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | CTDSP1 | Q9GZU7 | 3/20 | 0.59 |
| ▸ | AHR | P35869 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14938435 | 1.00 | NPC1 (0.62) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL15672281 | 0.82 | MAPT (0.63) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL9653683 | 0.80 | NPC1 (0.69) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL9653676 | 0.80 | NPC1 (0.69) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL8291422 | 0.80 | ALDH1A1 (0.84) | NPC1RAB9APOLBMAPTCTDSP1 | |
| SCHEMBL14938440 | 0.79 | RAB9A (0.63) | NPC1RAB9AMAPTCTDSP1ALDH1A1 | |
| SCHEMBL14938438 | 0.79 | RAB9A (0.63) | NPC1RAB9AMAPTCTDSP1ALDH1A1 | |
| SCHEMBL1562661 | 0.78 | CYP1A2 (0.76) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL6635372 | 0.78 | CYP1A2 (0.76) | NPC1RAB9APOLBMAPTTDP1 | |
| SCHEMBL1562660 | 0.78 | CYP1A2 (0.76) | NPC1RAB9APOLBMAPTTDP1 |
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 |