Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.55 |
| ▸ | HTR5A | P47898 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29957465 | 0.84 | TLR8 (0.46) | MCL1CYP1A2ENPP2ESR1ESR2 | |
| SCHEMBL4794960 | 0.84 | TLR8 (0.46) | MCL1CYP1A2ENPP2ESR1ESR2 | |
| SCHEMBL24807944 | 0.80 | CYP2A6 (0.45) | CYP1A2ENPP2TRPV1 | |
| SCHEMBL3200547 | 0.80 | CYP1A2 (0.59) | MCL1CYP1A2MEN1KMT2A | |
| SCHEMBL29951724 | 0.80 | CYP1A2 (0.59) | MCL1CYP1A2MEN1KMT2A | |
| SCHEMBL29091226 | 0.79 | CYP1A2 (0.41) | CYP1A2ENPP2KDM4EMEN1MAPT | |
| SCHEMBL29957471 | 0.78 | CTDSP1 (0.58) | ENPP2KDM4EMEN1MAPTKMT2A | |
| SCHEMBL28704846 | 0.78 | CYP2A6 (0.43) | CYP1A2MEN1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL6117604 | 0.78 | ALDH1A1 (0.61) | CYP1A2MAPT | |
| SCHEMBL16061157 | 0.78 | CYP1A2 (0.43) | CYP1A2ENPP2TRPV1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111936506-B | Compound and organic light-emitting element comprising same | 株式会社LG化学 | 2023-11-07 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| CN-111936506-A | Compound and organic light-emitting element comprising same | 株式会社LG化学 | 2020-11-13 | — | — | CN | disclosed |