Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20404983 | 0.93 | HPRT1 (0.48) | HPRT1CYP1A2TSHRCYP2A6ALDH1A1 | |
| SCHEMBL6318714 | 0.82 | ESR1 (0.58) | CYP1A2CYP2A6ALDH1A1ESR1ESR2 | |
| SCHEMBL6310662 | 0.81 | TSHR (0.56) | HPRT1CYP1A2TSHRCYP2A6ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL27919131 | 0.80 | TSHR (0.54) | HPRT1CYP1A2TSHRCYP2A6ALDH1A1 | |
| SCHEMBL22639413 | 0.79 | ESR1 (0.64) | HPRT1CYP1A2ESR1ESR2CYP3A4 | |
| SCHEMBL19336433 | 0.79 | HPRT1 (0.64) | HPRT1CYP1A2TSHRCYP2A6ALDH1A1 | |
| SCHEMBL14134222 | 0.79 | CYP1A2 (0.48) | CYP1A2TSHRCYP2A6ALDH1A1MAPT | |
| SCHEMBL30356330 | 0.79 | CYP1A2 (0.48) | CYP1A2TSHRCYP2A6ALDH1A1MAPT | |
| SCHEMBL30379142 | 0.79 | CYP1A2 (0.48) | CYP1A2TSHRCYP2A6ALDH1A1MAPT | |
| SCHEMBL28996491 | 0.79 | CYP1A2 (0.48) | CYP1A2TSHRCYP2A6ALDH1A1MAPT |
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-3351537-B1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG CHEMICAL LTD (KR) | 2023-01-18 | — | — | EP | disclosed |
| EP-3351536-A1 | ORGANIC LIGHT-EMITTING DEVICE | LG Chem, Ltd. (KR) | 2018-07-25 | — | — | EP | disclosed |