Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 10/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | PRKDC | P78527 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL736513 | 0.82 | ALDH1A1 (0.56) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL1748175 | 0.82 | ERN1 (0.66) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL27908987 | 0.81 | ERN1 (0.64) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL455724 | 0.81 | ERN1 (1.00) | ERN1ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL30933727 | 0.81 | ERN1 (1.00) | ERN1ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL29818677 | 0.78 | ERN1 (0.64) | ERN1ALDH1A1TSHRTDP1CYP3A4 | |
| SCHEMBL15348507 | 0.77 | ERN1 (0.58) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL5053891 | 0.77 | ERN1 (0.63) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL2422000 | 0.77 | ERN1 (0.58) | ERN1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL29956352 | 0.76 | ERN1 (0.58) | ERN1ALDH1A1KDM4ETSHRTDP1 |
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 |