Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30380673 | 0.82 | NLRP3 (0.62) | MAPTCNR1ALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL23952169 | 0.82 | NLRP3 (0.62) | MAPTCNR1ALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL25818411 | 0.80 | NLRP3 (0.44) | MAPTKDM4ETHRBCNR1ALDH1A1 | |
| SCHEMBL25818404 | 0.80 | NLRP3 (0.44) | MAPTKDM4ETHRBCNR1ALDH1A1 | |
| SCHEMBL23952043 | 0.75 | NLRP3 (0.46) | THRBMEN1KMT2ANLRP3LMNA | |
| SCHEMBL23952570 | 0.74 | NLRP3 (0.42) | KDM4ETHRBALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL7606781 | 0.72 | KDM4E (0.49) | MAPTKDM4ETHRBDPP4CNR1 | |
| SCHEMBL5453963 | 0.70 | KDM4E (0.49) | MAPTKDM4ETHRBDPP4CNR1 | |
| SCHEMBL5445576 | 0.70 | KDM4E (0.49) | MAPTKDM4ETHRBDPP4ALDH1A1 | |
| SCHEMBL25815943 | 0.69 | MAT2A (0.35) | NLRP3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021209539-A1 | PYRROLO[1,2-D][1,2,4]TRIAZINE-2-YL-ACETAMIDES AS INHIBITORS OF THE NLRP3 INFLAMMASOME PATHWAY | JANSSEN PHARMACEUTICA NV (BE) | 2021-10-21 | — | — | WO | disclosed |