Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | UTRN | P46939 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | LIPE | Q05469 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21662100 | 0.86 | MEN1 (0.33) | S1PR1MEN1CYP1A2KMT2AHSD17B10 | |
| SCHEMBL23944836 | 0.82 | ADORA2A (0.32) | MEN1ALDH1A1CYP1A2KMT2ASMN1; SMN2 | |
| SCHEMBL24973903 | 0.81 | PDE9A (0.33) | CYP1A2SMN1; SMN2 | |
| SCHEMBL179257 | 0.77 | HSD17B1 (0.35) | — | |
| SCHEMBL20152493 | 0.76 | IKBKB (0.42) | NR1H4BCHEACHELIPEKDM4E | |
| SCHEMBL25834415 | 0.74 | PIM1 (0.30) | KDM4EMEN1ALDH1A1TP53CYP1A2 | |
| SCHEMBL12640770 | 0.74 | ESR1 (0.33) | — | |
| SCHEMBL21662098 | 0.72 | ADORA2A (0.31) | — | |
| SCHEMBL23776067 | 0.72 | MEN1 (0.50) | KDM4EMEN1ALDH1A1TP53CYP1A2 | |
| SCHEMBL21662067 | 0.71 | ADORA2A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210328154-A1 | PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) | 2021-10-21 | — | — | US | disclosed |