Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | CTRC | Q99895 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL20933842 | 0.95 | CYP1A1 (0.37) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL20933349 | 0.94 | CYP1A1 (0.36) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL20933166 | 0.94 | MAPT (0.36) | MEN1KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL20934315 | 0.94 | CYP1A1 (0.34) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL20934024 | 0.94 | CYP1A1 (0.36) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL20933591 | 0.93 | KDM4E (0.34) | MEN1KMT2AALDH1A1KDM4ECYP1A2 | |
| SCHEMBL20933314 | 0.93 | KMT2A (0.32) | CYP1A1CYP1B1MEN1KMT2AALDH1A1 | |
| SCHEMBL20933162 | 0.93 | MEN1 (0.35) | MEN1KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL20933158 | 0.92 | MEN1 (0.34) | MEN1KMT2AALDH1A1KDM4EMAPT | |
| SCHEMBL20933316 | 0.91 | MEN1 (0.34) | MEN1KMT2AALDH1A1KDM4EMAPT |
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-2019078461-A1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2019-04-25 | — | — | WO | disclosed |