Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.54 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | STAT3 | P40763 | 1/20 | 0.49 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.48 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.48 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29249357 | 0.92 | KCNK3 (0.54) | PTPN1SMN1; SMN2MEN1MAPTKMT2A | |
| SCHEMBL29249362 | 0.82 | NPC1 (0.58) | SMN1; SMN2MEN1MAPTKMT2AKDM4E | |
| SCHEMBL29249372 | 0.77 | KCNK3 (0.62) | SMN1; SMN2MEN1KMT2AKDM4EPOLB | |
| SCHEMBL29249359 | 0.75 | KCNK3 (0.60) | SMN1; SMN2MEN1MAPTKMT2AKDM4E | |
| SCHEMBL2026664 | 0.73 | PTPN1 (0.96) | NR1H4PTPN1DEGS1TRPV1PARP1 | |
| SCHEMBL10136221 | 0.73 | PTPN1 (0.96) | NR1H4PTPN1DEGS1TRPV1SMN1; SMN2 | |
| SCHEMBL14160276 | 0.73 | PTPN1 (0.96) | NR1H4PTPN1DEGS1TRPV1SMN1; SMN2 | |
| SCHEMBL2834990 | 0.72 | PTPN1 (0.74) | NR1H4PTPN1DEGS1TRPV1SMN1; SMN2 | |
| SCHEMBL23226675 | 0.72 | HDAC1 (0.79) | NR1H4PTPN1DEGS1TRPV1SMN1; SMN2 | |
| SCHEMBL30116663 | 0.72 | HDAC1 (0.79) | NR1H4PTPN1DEGS1TRPV1SMN1; SMN2 |
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-118324653-A | Compound, metal compound, preparation method and application thereof, contrast agent and imaging method | 四川大学 | 2024-07-12 | — | — | CN | disclosed |