Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1004651 | 0.82 | RXRA (0.47) | TSHRMEN1KMT2ASMN1; SMN2PTGS1 | |
| SCHEMBL7902893 | 0.82 | TSHR (0.47) | TSHRMEN1KMT2ASMN1; SMN2PTGS1 | |
| SCHEMBL16960480 | 0.79 | SIGMAR1 (0.32) | MEN1KMT2ASMN1; SMN2KDM4EATM | |
| SCHEMBL12410575 | 0.76 | PTGS2 (0.36) | MEN1KMT2ASMN1; SMN2KDM4EATM | |
| SCHEMBL14252146 | 0.76 | PTGS2 (0.36) | MEN1KMT2ASMN1; SMN2KDM4EATM | |
| SCHEMBL12128208 | 0.76 | PARP1 (0.47) | TSHRSMN1; SMN2HTTPARP10ALDH1A1 | |
| SCHEMBL4515297 | 0.76 | PARP10 (0.47) | TSHRMEN1KMT2APTGS1PTGS2 | |
| SCHEMBL16957394 | 0.75 | — | — | |
| SCHEMBL17382019 | 0.74 | ADRA1D (0.49) | TSHRMEN1KMT2AKDM4EPTGS1 | |
| SCHEMBL13870393 | 0.74 | RXRA (0.41) | TSHRMEN1KMT2ASMN1; SMN2PTGS1 |
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-3904349-A2 | N-(CYCLOPROPYLMETHYL)-5-(METHYLSULFONYL)-N-{1-[1-(PYRIMIDIN-2-YL)-1H-1,2,4-TRIAZOL-5-YL]ETHYL}HETEROCYCLYL AMIDE DERIVATIVES AND SIMILAR COMPOUNDS AS PESTICIDES | Bayer Aktiengesellschaft (DE) | 2021-11-03 | — | — | EP | disclosed |