Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 3/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28403711 | 0.83 | MEN1 (0.36) | SLC6A2SLC6A4SLC6A3SMN1; SMN2RAB9A | |
| SCHEMBL28409512 | 0.82 | CASP6 (0.40) | SLC6A4DRD2DRD3KCNH2SMN1; SMN2 | |
| SCHEMBL28403820 | 0.81 | HSD17B3 (0.37) | DRD2DRD3KCNH2 | |
| SCHEMBL28408861 | 0.79 | TRPA1 (0.40) | SMN1; SMN2RAB9AKDM4ENPC1MAPT | |
| SCHEMBL28404066 | 0.78 | HSD17B3 (0.43) | DRD2DRD3KCNH2SMN1; SMN2RAB9A | |
| SCHEMBL28416960 | 0.78 | RAB9A (0.41) | SMN1; SMN2RAB9AKDM4ENPC1NFKB1 | |
| SCHEMBL28414014 | 0.76 | NPC1 (0.34) | SLC6A2DRD2DRD3SMN1; SMN2RAB9A | |
| SCHEMBL28417056 | 0.76 | TRPA1 (0.33) | — | |
| SCHEMBL28891007 | 0.76 | HSD17B3 (0.33) | DRD2DRD3RAB9ANPC1CYP2D6 | |
| SCHEMBL28890342 | 0.76 | TRPA1 (0.33) | RAB9AKDM4ENPC1CYP2D6MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111116487-B | Phthalazine compound, and synthetic method and application thereof | 西北农林科技大学 | 2022-08-23 | — | — | CN | claimed |
| CN-111116487-B | Phthalazine compound, and synthetic method and application thereof | 西北农林科技大学 | 2022-08-23 | — | — | CN | disclosed |
| CN-111116487-A | Phthalazine compound, and synthetic method and application thereof | 西北农林科技大学 | 2020-05-08 | — | — | CN | disclosed |