Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | BLM | P54132 | 2/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL429299 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL6594522 | 0.92 | ALOX15 (0.32) | ALOX15BLMPMP22KMT2AMCL1 | |
| SCHEMBL377071 | 0.81 | FAAH (0.32) | ALOX15BLMPMP22KMT2AKDM4E | |
| SCHEMBL1766736 | 0.79 | FAAH (0.35) | ALOX15KMT2AKDM4ETP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL376782 | 0.79 | KMT2A (0.31) | ALOX15BLMPMP22KMT2AKDM4E | |
| SCHEMBL24096259 | 0.77 | FAAH (0.39) | PMP22KMT2AKDM4ELMNATP53 | |
| Hydrochloric Acid SCHEMBL5707326 | 0.77 | FAAH (0.34) | ALOX15BLMKMT2AKDM4ETP53 | |
| SCHEMBL4439060 | 0.74 | CA1 (0.33) | ALOX15BLMPMP22KMT2AKDM4E | |
| SCHEMBL9282824 | 0.74 | — | — | |
| SCHEMBL1030177 | 0.74 | — | — |
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-109529057-B | Calcium ion response dual-mode magnetic resonance imaging probe and preparation method thereof | 厦门大学 | 2021-04-16 | — | — | CN | claimed |
| CN-109529057-B | Calcium ion response dual-mode magnetic resonance imaging probe and preparation method thereof | 厦门大学 | 2021-04-16 | — | — | CN | disclosed |
| CN-109529057-B | Calcium ion response dual-mode magnetic resonance imaging probe and preparation method thereof | 厦门大学 | 2021-04-16 | — | — | CN | disclosed |