Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.65 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 7/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | FBP1 | P09467 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | RET | P07949 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL28899743 | 0.87 | SLC22A12 (0.65) | SLC22A12NTSR1EGFRKDRRET | |
| SCHEMBL28899860 | 0.83 | SLC22A12 (0.58) | SLC22A12ABCG2LMNAMAPTKMT2A | |
| SCHEMBL28899847 | 0.81 | SLC22A12 (0.48) | SLC22A12EGFRABCG2 | |
| SCHEMBL28899756 | 0.80 | SLC22A12 (0.72) | SLC22A12NTSR1KDRKRASSOS1 | |
| SCHEMBL28899925 | 0.79 | SLC22A12 (0.87) | SLC22A12LMNAMAPTKMT2AKDM4E | |
| SCHEMBL29259548 | 0.79 | SLC22A12 (0.78) | SLC22A12NTSR1EGFRKDM4ETSHR | |
| SCHEMBL28960094 | 0.79 | SLC22A12 (0.72) | SLC22A12NTSR1EGFRKDRRET | |
| SCHEMBL28899857 | 0.78 | SLC22A12 (0.79) | SLC22A12LMNAMAPTKMT2AKDM4E | |
| SCHEMBL30104172 | 0.75 | SLC22A12 (0.61) | SLC22A12FLT1KDRRETHTT | |
| SCHEMBL30978153 | 0.74 | SLC22A12 (0.66) | SLC22A12EGFRMAPTKMT2AKDM4E |
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-115417825-B | Five-membered or six-membered fused ring pyrimidine cyclopropyl naphthalene derivative and preparation method and application thereof | 山东大学 | 2024-06-28 | — | — | CN | disclosed |
| CN-115417825-A | Five-membered or six-membered fused ring pyrimidine cyclopropyl naphthalene derivative and preparation method and application thereof | 山东大学 | 2022-12-02 | — | — | CN | disclosed |