Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 3/20 | 0.59 |
| ▸ | HCAR1 | Q9BXC0 | 2/20 | 0.52 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 2/20 | 0.40 |
| ▸ | RXRB | P28702 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21484010 | 0.87 | TPMT (0.42) | TPMTHCAR1HCAR2RXRARXRB | |
| SCHEMBL24135658 | 0.85 | PARP1 (0.43) | TPMTHCAR1HCAR2RXRARXRB | |
| SCHEMBL23976659 | 0.82 | TPMT (0.52) | TPMTHCAR1HCAR2TTRRXRA | |
| SCHEMBL23977148 | 0.79 | TPMT (0.52) | TPMTHCAR1HCAR2TTRRXRA | |
| SCHEMBL17071828 | 0.79 | TSHR (0.44) | TPMTTSHRALDH1A1TP53 | |
| SCHEMBL20826098 | 0.78 | TPMT (0.61) | TPMTHCAR1HCAR2RXRARXRB | |
| SCHEMBL23976710 | 0.78 | TPMT (0.50) | TPMTHCAR1HCAR2TTRRXRA | |
| SCHEMBL23699 | 0.76 | TPMT (1.00) | TPMTHCAR1HCAR2TTRRXRA | |
| SCHEMBL69625 | 0.76 | TPMT (0.89) | TPMTHCAR1HCAR2TTRRXRA | |
| SCHEMBL28214359 | 0.76 | TPMT (1.00) | TPMTHCAR1HCAR2TTRRXRA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3904350-A1 | N-(CYCLOPROPYLMETHYL)-5-(METHYLSULFONYL)-N-{1-[1-(PYRIMIDIN-2-YL)-1H-1,2,4-TRIAZOL-5-YL]ETHYL}BENZAMIDE DERIVATIVES AND THE CORRESPONDING PYRIDINE-CARBOXAMIDE DERIVATIVES AS PESTICIDES | Bayer Aktiengesellschaft (DE) | 2021-11-03 | — | — | EP | disclosed |