Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | CASP3 | P42574 | 3/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28029975 | 0.86 | AKR1C3 (0.44) | AKR1C3NPC1RAB9ACASP3SENP7 | |
| SCHEMBL28029985 | 0.84 | MEN1 (0.44) | AKR1C3MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL28029983 | 0.84 | MEN1 (0.44) | AKR1C3MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL28029976 | 0.80 | MAPT (0.45) | CYP1B1AKR1C3MEN1KMT2AKDM4E | |
| SCHEMBL28030361 | 0.80 | PTGS2 (0.42) | NPC1RAB9APTGS2MEN1KMT2A | |
| SCHEMBL28822075 | 0.80 | CYP1B1 (0.42) | CYP1B1AKR1C3NPC1RAB9APTGS2 | |
| SCHEMBL28030357 | 0.80 | MAOB (0.43) | AKR1C3NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28029986 | 0.77 | KMT2A (0.44) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL28029993 | 0.76 | P4HB (0.44) | KMT2AKDM4EALDH1A1PKM | |
| SCHEMBL22493010 | 0.75 | AKR1C1 (0.46) | CYP1B1AKR1C3NPC1RAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104926867-A | Preparation method for alkenyl phosphate compound | UNIV BEIJING | 2015-09-23 | — | — | CN | disclosed |