Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.34 |
| ▸ | RXRB | P28702 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 6/20 | 0.33 |
| ▸ | RAB9A | P51151 | 6/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL839994 | 0.91 | ACHE (0.46) | ACHERXRARXRBNPC1RAB9A | |
| SCHEMBL2774036 | 0.89 | ACHE (0.42) | ACHETDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5461557 | 0.80 | ACHE (0.42) | ACHETDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29104461 | 0.78 | ACHE (0.36) | ACHETDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1046627 | 0.71 | RXRA (0.56) | ACHERXRARXRBTDP1NPC1 | |
| SCHEMBL3824145 | 0.71 | CCR1 (0.42) | TDP1KDM4EMEN1KMT2A | |
| SCHEMBL4647857 | 0.71 | NPC1 (0.49) | ACHETDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1815469 | 0.70 | ACHE (0.36) | ACHETDP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9119298 | 0.69 | PTGS2 (0.38) | SMN1; SMN2KDM4EALDH1A1KMT2AHPGD | |
| SCHEMBL7914615 | 0.69 | LMNA (0.41) | ACHETDP1NPC1RAB9ASMN1; SMN2 |
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-3850055-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | Merck Patent GmbH (DE) | 2021-07-21 | — | — | EP | disclosed |
| WO-2020053150-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2020-03-19 | — | — | WO | disclosed |