Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.34 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 5/20 | 0.31 |
| ▸ | MPO | P05164 | 1/20 | 0.31 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11778461 | 0.76 | TLR8 (0.36) | TLR8KDRMPOSLC9A1CNR1 | |
| SCHEMBL693498 | 0.69 | ALDH1A1 (0.37) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL1075720 | 0.69 | ALDH1A1 (0.37) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL2791515 | 0.68 | KDM4E (0.36) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL693077 | 0.67 | GRK6 (0.36) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL3781653 | 0.67 | ALDH1A1 (0.36) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL3777245 | 0.66 | ALDH1A1 (0.33) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL4759555 | 0.66 | KDR (0.37) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL6529244 | 0.65 | KDM4E (0.33) | KDM4EALDH1A1GLAPOLBGAA | |
| SCHEMBL2073708 | 0.65 | PKM (0.49) | KDM4EALDH1A1GLAPOLBGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1222173-B1 | PROCESS FOR PREPARING 4-TRIFLUOROMETHYLSULPHINYLPYRAZOLE DERIVATIVE | BAYER CROPSCIENCE SA (FR) | 2004-08-18 | — | — | EP | disclosed |
| US-6620943-B1 | Oxidation of 5-amino-1-(2,6-dichloro-4-trifluoromethylphenyl) -3-cyano-4-trifluoromethylthiopyrazole with trifluoroperacetic acid in the presence of boric acid to form fipronil, used as pesticides | BAYER CROPSCIENCE SA (FR) | 2003-09-16 | — | — | US | disclosed |