Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 6/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 4/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TPH1 | P17752 | 1/20 | 0.32 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 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 | |
|---|---|---|---|---|
| SCHEMBL21295092 | 0.84 | ALDH1A1 (0.43) | NOTUMCNR2HSD17B10TP53 | |
| SCHEMBL28546819 | 0.83 | NOTUM (0.40) | NOTUMCNR2GPR35PTGER4CCR2 | |
| SCHEMBL28542131 | 0.83 | NOTUM (0.40) | NOTUMCNR2GPR35PTGER4CNR1 | |
| SCHEMBL28546837 | 0.82 | NOTUM (0.40) | NOTUMCNR2GPR35CNR1CCR2 | |
| SCHEMBL21307466 | 0.79 | NOTUM (0.43) | NOTUMCNR2CNR1TPH1TPH2 | |
| SCHEMBL21295041 | 0.77 | NOTUM (0.36) | NOTUMCNR2 | |
| SCHEMBL21295036 | 0.76 | NOTUM (0.35) | NOTUMCNR2TPH1TPH2 | |
| SCHEMBL28538325 | 0.76 | NOTUM (0.41) | NOTUMTP53CCR2 | |
| SCHEMBL23159601 | 0.72 | CNR2 (0.38) | NOTUMCNR2HSD17B10TP53CNR1 | |
| SCHEMBL23159624 | 0.72 | ALDH1A1 (0.39) | NOTUMCNR2HSD17B10TP53 |
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-112574230-B | Peptidyl arginine deiminase inhibitors and uses thereof | 药捷安康(南京)科技股份有限公司 | 2022-10-28 | — | — | CN | disclosed |
| CN-110194770-B | Peptidyl arginine deiminase inhibitors and uses thereof | 药捷安康(南京)科技股份有限公司 | 2022-08-09 | — | — | CN | disclosed |