Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CTRC | Q99895 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL18965333 | 0.92 | MEN1 (0.38) | MEN1KMT2AALDH1A1HPGDMAPT | |
| SCHEMBL18965340 | 0.83 | MEN1 (0.34) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL18965409 | 0.83 | — | — | |
| SCHEMBL18965461 | 0.81 | CYP1A1 (0.38) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL27460043 | 0.80 | P2RX7 (0.39) | MEN1KMT2AALDH1A1HPGDMAPT | |
| SCHEMBL27380717 | 0.79 | HSD17B1 (0.35) | MEN1KMT2AALDH1A1HPGDMAPT | |
| SCHEMBL27271303 | 0.79 | P2RX7 (0.37) | MEN1KMT2AALDH1A1HPGDMAPT | |
| SCHEMBL27382317 | 0.78 | HSD17B1 (0.35) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL24890297 | 0.78 | ALDH1A1 (0.31) | MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL27275112 | 0.78 | MEN1 (0.33) | MEN1KMT2AALDH1A1HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017099430-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2017-06-15 | — | — | WO | disclosed |