Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.59 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.47 |
| ▸ | SRC | P12931 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Ethylenediamine SCHEMBL731207 | 0.91 | TRPA1 (0.50) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL28238190 | 0.82 | TRPA1 (0.62) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL11529752 | 0.82 | LMNA (0.57) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL7864024 | 0.82 | MEN1 (0.44) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL9294948 | 0.81 | TRPA1 (0.55) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| Thymol SCHEMBL28080455 | 0.81 | TRPA1 (0.78) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL31413333 | 0.80 | KMT2A (0.57) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| Thymol SCHEMBL28150359 | 0.80 | TRPA1 (0.84) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| Thymol SCHEMBL29152602 | 0.79 | LMNA (0.75) | TRPA1CHRM1LMNASLC6A2ADRA1A | |
| SCHEMBL19444459 | 0.79 | TYR (0.48) | MEN1KMT2AALDH1A1 |
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-2726442-A1 | MODIFIED AMINOCARBOXYLATES WITH IMPROVED SHELF LIFE AND PROCESSING PROPERTIES | BASF SE (DE) | 2014-05-07 | — | — | EP | disclosed |
| WO-2013000848-A1 | MODIFIED AMINOCARBOXYLATES WITH IMPROVED SHELF LIFE AND PROCESSING PROPERTIES | BASF SE (DE) | 2013-01-03 | — | — | WO | disclosed |