Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN10A | Q9Y5Y9 | 4/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.35 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PPIB | P23284 | 1/20 | 0.33 |
| ▸ | PPIA | P62937 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30530103 | 1.00 | SCN10A (0.36) | SCN10AMRGPRX4PTGDR2FFAR4BCL2L1 | |
| SCHEMBL30530175 | 0.86 | PTGDR2 (0.44) | MRGPRX4PTGDR2 | |
| SCHEMBL25376597 | 0.86 | PTGDR2 (0.44) | MRGPRX4PTGDR2 | |
| SCHEMBL20638748 | 0.84 | SCN10A (0.40) | SCN10AMRGPRX4FFAR4PIM1DHODH | |
| SCHEMBL20638758 | 0.82 | SCN10A (0.42) | SCN10AMRGPRX4FFAR4 | |
| SCHEMBL20638747 | 0.82 | MRGPRX4 (0.48) | SCN10AMRGPRX4FFAR4DHODHSCN5A | |
| SCHEMBL20638986 | 0.81 | EPHX2 (0.43) | SCN10ATRPV1 | |
| SCHEMBL20639068 | 0.81 | SCN10A (0.52) | SCN10AMRGPRX4FFAR4PTGS1PTGS2 | |
| SCHEMBL22216163 | 0.80 | SCN10A (0.41) | SCN10AMRGPRX4FFAR4PIM1PTGS1 | |
| SCHEMBL29062012 | 0.79 | SCN10A (0.42) | SCN10A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023160509-A1 | AMIDINE DERIVATIVE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2023-08-31 | — | — | WO | disclosed |
| CN-116655497-A | Amidine derivative compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2023-08-29 | — | — | CN | disclosed |