Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.49 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.49 |
| ▸ | RAD52 | P43351 | 1/20 | 0.49 |
| ▸ | NMT2 | O60551 | 1/20 | 0.48 |
| ▸ | NMT1 | P30419 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28424469 | 0.92 | MEN1 (0.53) | CYP2D6MEN1KMT2AKDM4EADRB2 | |
| SCHEMBL28405873 | 0.92 | CYP2D6 (0.52) | CYP2D6MEN1KMT2AKDM4EADRB2 | |
| SCHEMBL28420170 | 0.91 | MEN1 (0.54) | MEN1KMT2AKDM4EADRB2ADRB1 | |
| SCHEMBL28415086 | 0.87 | MEN1 (0.52) | CYP2D6MEN1KMT2AKDM4EADRB2 | |
| SCHEMBL28405880 | 0.85 | MEN1 (0.47) | CYP2D6MEN1KMT2AADRB2ADRB1 | |
| SCHEMBL28400173 | 0.84 | TUBB4A (0.50) | MEN1KMT2AKDM4EADRB2ADRB1 | |
| SCHEMBL28415024 | 0.81 | ADRB2 (0.58) | MEN1KMT2AKDM4EADRB2ADRB1 | |
| SCHEMBL28404281 | 0.80 | ADRB2 (0.51) | CYP2D6ADRB2ADRB1ADRB3 | |
| SCHEMBL28411240 | 0.80 | MEN1 (0.54) | MEN1KMT2AKDM4EADRB2ADRB1 | |
| SCHEMBL28417224 | 0.79 | MEN1 (0.55) | MEN1KMT2AKDM4EADRB2ADRB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107857748-B | 5- [ 2-hydroxy-3- (alkylamino) propoxy ] benzofuran compound and application thereof | 沈阳药科大学 | 2020-06-02 | — | — | CN | claimed |
| CN-107857748-B | 5- [ 2-hydroxy-3- (alkylamino) propoxy ] benzofuran compound and application thereof | 沈阳药科大学 | 2020-06-02 | — | — | CN | disclosed |