Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 4/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | HTR5A | P47898 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30878610 | 0.82 | HSD11B1 (0.54) | HSD11B1ADRA2AADRA1AADRA1DADRA1B | |
| SCHEMBL1011305 | 0.82 | HSD11B1 (0.54) | HSD11B1ADRA2AADRA1AADRA1DADRA1B | |
| SCHEMBL10518205 | 0.77 | HSD11B1 (0.52) | HSD11B1HTR2CADRA2AADRA1AMAPKAPK2 | |
| SCHEMBL9529706 | 0.75 | HSD11B1 (0.47) | HSD11B1ADRA2AADRA1AADRA1DADRA1B | |
| SCHEMBL10607758 | 0.75 | CYP19A1 (0.52) | HSD11B1ADRA2AADRA1ACA1CA2 | |
| SCHEMBL29118108 | 0.74 | HTR2C (0.47) | HTR2CHTR1AMEN1DRD2KMT2A | |
| SCHEMBL7680743 | 0.72 | CA1 (0.55) | HSD11B1CA1CA2CYP19A1 | |
| SCHEMBL9529211 | 0.72 | SIGMAR1 (0.48) | HSD11B1HTR1A | |
| SCHEMBL3061865 | 0.72 | L3MBTL1 (0.50) | HSD11B1HTR2CHTR2AADRA2AADRA1A | |
| SCHEMBL13100026 | 0.72 | GID4 (0.45) | HSD11B1HTR2CHTR2ACA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104045552-B | Medicinal compound as neuroprotective agent | 江苏先声药业有限公司 | 2019-06-11 | — | — | CN | disclosed |