Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PLK1 | P53350 | 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 | |
|---|---|---|---|---|
| SCHEMBL20008914 | 0.95 | PDK1 (0.32) | CYP1A2CYP2D6CYP2C19BRD4TSHR | |
| SCHEMBL16020244 | 0.85 | ADRB2 (0.43) | CYP1A2CYP2D6TSHRNR4A2ALDH1A1 | |
| SCHEMBL20008928 | 0.83 | CYP2C19 (0.40) | CYP1A2CYP2D6CYP2C19ELANEMAPT | |
| SCHEMBL16020253 | 0.81 | LMNA (0.44) | TSHRELANEPRTN3ALDH1A1MAPT | |
| SCHEMBL16020249 | 0.81 | ALDH1A1 (0.40) | TSHRELANEPRTN3ALDH1A1 | |
| SCHEMBL16020243 | 0.79 | CYP2D6 (0.47) | CYP1A2CYP2D6CYP2C19TSHRALDH1A1 | |
| SCHEMBL16020248 | 0.78 | ALDH1A1 (0.44) | CYP1A2CYP2C19ALDH1A1MAPT | |
| SCHEMBL19846366 | 0.77 | — | — | |
| SCHEMBL16020238 | 0.77 | KDM4E (0.40) | CYP2D6ELANEPRTN3ALDH1A1MAPT | |
| SCHEMBL16020246 | 0.72 | GABBR2 (0.41) | ALDH1A1MAPT |
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-20180085019-A1 | ADHESIVE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING A BIO-ELECTRODE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-03-29 | — | — | US | disclosed |