Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NQO1 | P15559 | 1/20 | 0.37 |
| ▸ | CDC25A | P30304 | 1/20 | 0.37 |
| ▸ | CDC25C | P30307 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | PMM2 | O15305 | 1/20 | 0.35 |
| ▸ | MPI | P34949 | 1/20 | 0.35 |
| ▸ | PHOSPHO1 | Q8TCT1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8962028 | 0.87 | ESR1 (0.49) | PARP1MAOBMEN1KMT2ANQO1 | |
| SCHEMBL24727004 | 0.86 | GABRP (0.43) | PARP1MEN1KMT2ANQO1CDC25A | |
| SCHEMBL11711426 | 0.81 | CYP1A2 (0.47) | MAOBMEN1KMT2ACDC25ACDC25C | |
| SCHEMBL17942791 | 0.79 | MAOB (0.41) | MAOBMEN1KMT2ANQO1CDC25A | |
| SCHEMBL23105634 | 0.79 | KDM4E (0.58) | MEN1KMT2ARAB9AHPGDSMN1; SMN2 | |
| SCHEMBL21638102 | 0.79 | TTR (0.47) | MAOBMEN1KMT2ANQO1CDC25A | |
| SCHEMBL2966509 | 0.79 | AHR (0.59) | CDC25ACDC25CRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL31248014 | 0.79 | MAOB (0.41) | MAOBMEN1KMT2ANQO1CDC25A | |
| SCHEMBL31420462 | 0.79 | KDM4E (0.58) | MEN1KMT2ARAB9AHPGDSMN1; SMN2 | |
| SCHEMBL23627796 | 0.77 | CHEK1 (0.48) | MAOBMEN1KMT2ARAB9AHPGD |
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-4074706-A1 | DEUTERATED HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DEVICE | LG Display Co., Ltd. (KR) | 2022-10-19 | — | — | EP | disclosed |