Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 10/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ERCC1 | P07992 | 3/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 3/20 | 0.45 |
| ▸ | GALR3 | O60755 | 1/20 | 0.44 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL7614072 | 0.72 | TAS1R3 (0.58) | SIGMAR1KMT2AMEN1ALDH1A1LMNA | |
| Bicarbonate SCHEMBL7622161 | 0.71 | SIGMAR1 (0.62) | SIGMAR1P2RX7KMT2AERCC1ERCC4 | |
| Bicarbonate SCHEMBL9043289 | 0.71 | KMT2A (0.57) | SIGMAR1P2RX7KMT2AMEN1ALDH1A1 | |
| Bicarbonate SCHEMBL9044829 | 0.71 | LMNA (0.42) | P2RX7KMT2AMEN1LMNAHPGD | |
| SCHEMBL30545006 | 0.70 | ALDH1A1 (0.65) | P2RX7KMT2AERCC1ERCC4GALR3 | |
| SCHEMBL4247795 | 0.70 | ERCC1 (0.56) | P2RX7KMT2AERCC1ERCC4GALR3 | |
| SCHEMBL9523440 | 0.70 | ALDH1A1 (0.65) | P2RX7KMT2AERCC1ERCC4GALR3 | |
| Bicarbonate SCHEMBL7620040 | 0.70 | SIGMAR1 (0.55) | SIGMAR1P2RX7KMT2AGALR3NR2F2 | |
| Cyanide SCHEMBL27411534 | 0.69 | ALDH1A1 (0.54) | P2RX7KMT2AMEN1ALDH1A1MAPT | |
| Bicarbonate SCHEMBL7615737 | 0.69 | SIGMAR1 (0.60) | SIGMAR1P2RX7KMT2AERCC1ERCC4 |
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-1099420-C | Substituted spiroheterocyclic 1H-3-arylpyrrolidine-2,4-dione derivatives, methods of preparing them and their use as pest-control agents | BAYER AG (DE) | 2003-01-22 | — | — | CN | disclosed |
| CN-1126475-A | Substituted spiroheterocyclic 1H-3-arylpyrrolidine-2,4-dione derivatives, methods of preparing them and their use as pest-control agents | BAYER AG (DE) | 1996-07-10 | — | — | CN | disclosed |