Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 4/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 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 | |
|---|---|---|---|---|
| SCHEMBL23400392 | 0.92 | ESR1 (0.36) | MEN1KMT2AESR1RAB9ASMN1; SMN2 | |
| SCHEMBL23399626 | 0.88 | NR1H3 (0.46) | NR1H3MEN1KMT2AESR1CYP1A2 | |
| SCHEMBL23400619 | 0.86 | MAPT (0.39) | RAB9ASMN1; SMN2CYP1A2HTTLMNA | |
| SCHEMBL23398757 | 0.85 | TP53 (0.44) | NR1H3MEN1KMT2AESR1CYP1A2 | |
| SCHEMBL23401042 | 0.83 | CNR1 (0.41) | NR1H3MEN1KMT2AESR1RAB9A | |
| SCHEMBL23403144 | 0.82 | NR1H3 (0.40) | NR1H3MEN1KMT2AESR1RAB9A | |
| SCHEMBL23400463 | 0.82 | NR1H3 (0.38) | NR1H3MEN1KMT2AESR1RAB9A | |
| SCHEMBL23401464 | 0.81 | NR1H3 (0.40) | NR1H3MEN1KMT2AESR1RAB9A | |
| SCHEMBL23400405 | 0.81 | ESR1 (0.39) | NR1H3MEN1KMT2AESR1RAB9A | |
| SCHEMBL23401970 | 0.81 | NR1H3 (0.38) | NR1H3MEN1KMT2AESR1RAB9A |
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-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |