Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 5/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 6/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL9768033 | 0.82 | RAB9A (0.53) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768332 | 0.82 | AGTR1 (0.53) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768156 | 0.82 | AGTR1 (0.53) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768244 | 0.78 | NPC1 (0.49) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768037 | 0.77 | AGTR1 (0.48) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768040 | 0.76 | ALDH1A1 (0.52) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768041 | 0.75 | RAB9A (0.44) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768236 | 0.73 | AGTR1 (0.53) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL570885 | 0.71 | AGTR1 (0.54) | AGTR1RAB9AKDM4EAKR1C3MEN1 | |
| SCHEMBL9768265 | 0.70 | AKR1C3 (0.64) | AGTR1RAB9AKDM4EAKR1C3MEN1 |
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-5047592-A | Selective hydrogenolysis process | ETHYL CORPORATION (US) | 1991-09-10 | — | — | US | disclosed |