Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.41 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | RRM1 | P23921 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16638989 | 0.84 | CYP1A2 (0.41) | CYP1A2CYP2A6TSHRL3MBTL1MAPT | |
| SCHEMBL13589331 | 0.83 | CA1 (0.42) | CRHR1CYP1A2EGFRPDGFRBKDR | |
| SCHEMBL16638997 | 0.80 | CYP1A2 (0.42) | CYP1A2CYP2A6TSHRL3MBTL1ALDH1A1 | |
| SCHEMBL16638995 | 0.79 | CA12 (0.41) | CYP1A2CYP2A6TSHRALDH1A1CYP1A1 | |
| SCHEMBL27665913 | 0.79 | CYP1A2 (0.47) | CYP1A2CYP2A6TSHRL3MBTL1MAPT | |
| SCHEMBL14902012 | 0.78 | CA1 (0.38) | CRHR1CYP1A2EGFRPDGFRBKDR | |
| SCHEMBL16638988 | 0.78 | MAPT (0.38) | CYP1A2CYP2A6TSHRCYP17A1LMNA | |
| SCHEMBL23044729 | 0.76 | CYP1A2 (0.61) | CYP1A2CYP2A6LMNAL3MBTL1MAPT | |
| SCHEMBL16638987 | 0.76 | CYP1A2 (0.36) | CRHR1CYP1A2CYP2A6TSHRL3MBTL1 | |
| SCHEMBL14134243 | 0.75 | ACACA (0.49) | CYP11B1CYP11B2CYP1A2CYP2A6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2439190-B1 | AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENTS | TOSOH CORP (JP) | 2015-04-15 | — | — | EP | disclosed |