Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.30 |
| ▸ | MLNR | O43193 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11996934 | 0.88 | KMT2A (0.36) | CYP1A2CYP2C19KMT2AKCNQ2PDK2 | |
| SCHEMBL17263276 | 0.84 | PDK2 (0.33) | CYP1A2CYP2C19KMT2AKCNQ2MLNR | |
| SCHEMBL18571628 | 0.81 | PDK2 (0.38) | CYP1A2CYP2C19KMT2AADRA1APDK2 | |
| SCHEMBL12320586 | 0.77 | CYP2A6 (0.40) | CYP1A2CYP2C19KMT2AHTR1AHTR2A | |
| SCHEMBL17263284 | 0.75 | PDK2 (0.38) | PDK2 | |
| SCHEMBL17263265 | 0.75 | CCR1 (0.37) | CYP1A2 | |
| SCHEMBL18571287 | 0.74 | KDM4E (0.44) | CYP1A2KMT2APDK2 | |
| SCHEMBL14495844 | 0.74 | NQO2 (0.33) | KMT2AMLNRNR1I2CHRM2ADRB1 | |
| SCHEMBL14495843 | 0.73 | JAK3 (0.37) | KMT2APDK2 | |
| SCHEMBL17263285 | 0.73 | PDK2 (0.34) | PDK2 |
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-9187689-B2 | Organometallic complex and light-emitting element, light-emitting device, and electronic device using the same | SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) | 2015-11-17 | — | — | US | disclosed |