Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11020218 | 1.00 | DRD2 (0.39) | DRD2ADRA1AHSD11B1ACHEMBTD1 | |
| SCHEMBL11245835 | 0.92 | KMT2A (0.41) | DRD2ADRA1AHSD11B1ACHEMBTD1 | |
| SCHEMBL6216411 | 0.89 | DRD2 (0.44) | DRD2ADRA1AHSD11B1ACHEMBTD1 | |
| SCHEMBL10744875 | 0.85 | LMNA (0.34) | DRD2ADRA1AHSD11B1ACHECA1 | |
| SCHEMBL1816491 | 0.85 | LMNA (0.34) | DRD2ADRA1AHSD11B1ACHECA1 | |
| SCHEMBL10116766 | 0.85 | DRD2 (0.33) | DRD2ADRA1AHSD11B1ACHE | |
| Hydrochloric Acid SCHEMBL407954 | 0.83 | DRD2 (0.33) | DRD2ADRA1AHSD11B1ACHE | |
| SCHEMBL20281987 | 0.83 | KMT2A (0.34) | DRD2ADRA1AHSD11B1ACHEMT-CO2 | |
| SCHEMBL20281783 | 0.83 | KMT2A (0.34) | DRD2ADRA1AHSD11B1ACHEMT-CO2 | |
| Ethoxycarbonyl Group SCHEMBL27615319 | 0.82 | ADRA1A (0.35) | DRD2ADRA1AHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019174533-A1 | SMALL MOLECULE PD-1/PD-L1 INHIBITOR AND USE THEREOF IN DRUGS | 广东东阳光药业有限公司 | 2019-09-19 | — | — | WO | disclosed |
| EP-0142920-A2 | 6-Oxodecahydroquinolines and process for their preparation | ELI LILLY AND COMPANY (US) | 1985-05-29 | — | — | EP | disclosed |