Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL17033657 | 0.93 | KDM4E (0.35) | HPRT1ALDH1A1KDM4EATML3MBTL1 | |
| SCHEMBL17033732 | 0.86 | HPRT1 (0.38) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL17033628 | 0.86 | KDM4E (0.43) | ALDH1A1KDM4EATML3MBTL1MAPT | |
| SCHEMBL17033808 | 0.86 | HPRT1 (0.35) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL17228249 | 0.84 | KDM4E (0.52) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL26809663 | 0.84 | HPRT1 (0.47) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL26809660 | 0.83 | HPRT1 (0.42) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL17033622 | 0.82 | ATM (0.39) | ALDH1A1HSD17B10HIF1ACYP1A2CYP2C9 | |
| SCHEMBL26809537 | 0.81 | ALDH1A1 (0.41) | HPRT1ALDH1A1HSD17B10CYP1B1HIF1A | |
| SCHEMBL17033637 | 0.81 | HSD17B1 (0.38) | CYP1A2CYP2C9CYP2C19KDM4EATM |
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-2015125986-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2015-08-27 | — | — | WO | disclosed |