Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
| ▸ | ACP3 | P15309 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5682335 | 1.00 | ALDH1A1 (0.51) | ALDH1A1POLBKMT2AKDM4EGMNN | |
| SCHEMBL5682340 | 1.00 | ALDH1A1 (0.51) | ALDH1A1POLBKMT2AKDM4EGMNN | |
| SCHEMBL7955002 | 0.83 | CA12 (0.57) | ALDH1A1POLBKMT2AKDM4EGMNN | |
| SCHEMBL3885828 | 0.81 | CNR2 (0.57) | ALDH1A1POLBKDM4EHPGDCA12 | |
| SCHEMBL182775 | 0.81 | CNR2 (0.57) | ALDH1A1POLBKDM4EHPGDCA12 | |
| SCHEMBL10080089 | 0.81 | CNR2 (0.57) | ALDH1A1POLBKDM4EHPGDCA12 | |
| SCHEMBL20874448 | 0.80 | CNR2 (0.53) | HPGD | |
| SCHEMBL6333241 | 0.79 | ALDH1A1 (0.51) | ALDH1A1POLBKMT2ACA12CA7 | |
| SCHEMBL9184442 | 0.79 | ALDH1A1 (0.51) | ALDH1A1POLBKMT2ACA12CA7 | |
| SCHEMBL1938001 | 0.79 | ALDH1A1 (0.51) | ALDH1A1POLBKMT2AKDM4EGMNN |
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 |
|---|---|---|---|---|---|---|---|
| EP-1229019-A1 | PROCESS FOR THE PRODUCTION OF OPTICALLY ACTIVE CYCLIC ENAMINONE DERIVATIVES | Takeda Chemical Industries, Ltd. (JP) | 2002-08-07 | — | — | EP | disclosed |