Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TOP2A | P11388 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | PI4KA | P42356 | 1/20 | 0.35 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.35 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL253096 | 1.00 | GPR3 (0.50) | GPR3KDM4EMAPTTOP2ACYP3A4 | |
| SCHEMBL2048246 | 0.79 | PDPK1 (0.47) | GPR3KDM4EMAPTTOP2ACYP3A4 | |
| SCHEMBL9837615 | 0.78 | MAPT (0.67) | KDM4EMAPTCYP3A4SMN1; SMN2ERN1 | |
| SCHEMBL729397 | 0.76 | KDM4E (0.47) | KDM4EMAPTCYP3A4ALOX15SMN1; SMN2 | |
| SCHEMBL729398 | 0.76 | LMNA (0.45) | KDM4EMAPTCYP3A4SMN1; SMN2 | |
| SCHEMBL1727666 | 0.73 | KDM4E (0.52) | GPR3KDM4ETOP2APDPK1CYP1A2 | |
| SCHEMBL30951595 | 0.73 | KDM4E (0.52) | GPR3KDM4ETOP2APDPK1CYP1A2 | |
| SCHEMBL30665271 | 0.73 | KDM4E (0.47) | GPR3KDM4EMAPTTOP2ACYP3A4 | |
| SCHEMBL19020845 | 0.73 | GPR3 (0.68) | GPR3KDM4EMAPTTOP2ACYP3A4 | |
| SCHEMBL8763443 | 0.71 | ALDH1A1 (0.52) | GPR3KDM4EMAPTCYP3A4SMN1; 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-112521387-B | NLRP3 modulators | 先天肿瘤免疫公司 | 2023-08-22 | — | — | CN | disclosed |