Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.46 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 1/20 | 0.37 |
| ▸ | CCR8 | P51685 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20851460 | 0.88 | TSHR (0.47) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL20851462 | 0.88 | TSHR (0.47) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL20851461 | 0.88 | TSHR (0.47) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL3653638 | 0.87 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL21742112 | 0.81 | SLC6A2 (0.45) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL12846948 | 0.80 | KCNA5 (0.44) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL28547813 | 0.80 | SLC6A2 (0.50) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL14862093 | 0.79 | SLC6A4 (0.44) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL24072870 | 0.79 | SLC6A2 (0.44) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 | |
| SCHEMBL21742035 | 0.79 | SLC6A4 (0.44) | SLC6A2SLC6A4SLC6A3KCNA5KCNE1 |
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-3904330-A1 | ETHYLENEDIAMINE COMPOUND AND USE THEREOF | Academy Of Military Medical Sciences (CN) | 2021-11-03 | — | — | EP | disclosed |