Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14938727 | 0.82 | NPC1 (0.43) | ALDH1A1RAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL16974393 | 0.79 | ALDH1A1 (0.39) | ALDH1A1RAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL9038549 | 0.73 | — | — | |
| SCHEMBL9038543 | 0.73 | — | — | |
| SCHEMBL6883819 | 0.73 | DAO (0.40) | ALDH1A1RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL6883821 | 0.73 | DAO (0.40) | ALDH1A1RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL6983491 | 0.72 | CYP2C19 (0.42) | ALDH1A1RAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL7270484 | 0.71 | CYP2C19 (0.49) | ALDH1A1RAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL9656857 | 0.71 | NPC1 (0.69) | ALDH1A1RAB9ANPC1SMN1; SMN2KMT2A | |
| SCHEMBL9656862 | 0.71 | NPC1 (0.69) | ALDH1A1RAB9ANPC1SMN1; SMN2KMT2A |
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 |