Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 2/20 | 0.42 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 11/20 | 0.39 |
| ▸ | FABP4 | P15090 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | HTR1B | P28222 | 2/20 | 0.36 |
| ▸ | HTR1F | P30939 | 2/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20839545 | 1.00 | SRC (0.42) | SRCNOD1CXCL8PTGDRPTGDR2 | |
| SCHEMBL16796191 | 0.81 | CNR2 (0.43) | SRCNOD1CXCL8HTR6 | |
| SCHEMBL25422879 | 0.80 | MTNR1B (0.55) | SRCHTR6FABP4 | |
| SCHEMBL20841436 | 0.79 | SRC (0.40) | SRCNOD1CXCL8PTGDRPTGDR2 | |
| SCHEMBL30276218 | 0.78 | CA12 (0.52) | SRCNOD1CXCL8HTR6CA12 | |
| SCHEMBL369194 | 0.78 | CA12 (0.52) | SRCNOD1CXCL8HTR6CA12 | |
| SCHEMBL16795088 | 0.76 | SRC (0.40) | SRCNOD1CXCL8HTR6HTR1A | |
| SCHEMBL20853109 | 0.75 | PTGDR2 (0.42) | SRCNOD1CXCL8PTGDRPTGDR2 | |
| SCHEMBL17927607 | 0.75 | ACLY (0.44) | SRCNOD1PTGDRPTGDR2HTR6 | |
| SCHEMBL30158830 | 0.75 | SRC (0.37) | SRCNOD1CXCL8PTGDRPTGDR2 |
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-111108105-B | Heterocyclic compounds as PAD inhibitors | 朱比兰特埃皮帕德有限公司 | 2023-03-31 | — | — | CN | disclosed |
| CN-111225915-B | Imidazopyridine compounds as PAD inhibitors | 朱比兰特埃皮帕德有限公司 | 2023-03-07 | — | — | CN | disclosed |