Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11066558 | 0.90 | ALDH1A1 (0.50) | CYP1A2CYP3A4L3MBTL1HPGDCYP2C19 | |
| SCHEMBL31195785 | 0.84 | ALDH1A1 (0.48) | CYP3A4L3MBTL1HPGDKDM4EALDH1A1 | |
| SCHEMBL188682 | 0.84 | ALDH1A1 (0.48) | CYP3A4L3MBTL1HPGDKDM4EALDH1A1 | |
| SCHEMBL27846190 | 0.81 | ESR1 (0.46) | CYP1A2CYP3A4L3MBTL1HPGDALDH1A1 | |
| SCHEMBL14134222 | 0.81 | CYP1A2 (0.48) | CYP1A2CYP3A4L3MBTL1HPGDCYP2C19 | |
| SCHEMBL30356330 | 0.81 | CYP1A2 (0.48) | CYP1A2CYP3A4L3MBTL1HPGDCYP2C19 | |
| SCHEMBL30562860 | 0.81 | CA1 (0.44) | CYP1A2CYP3A4HPGDCYP2C19ALDH1A1 | |
| SCHEMBL29418178 | 0.80 | ALDH1A1 (0.56) | CYP1A2CYP3A4HPGDALDH1A1TSHR | |
| SCHEMBL455943 | 0.80 | ALDH1A1 (0.56) | CYP1A2CYP3A4HPGDALDH1A1TSHR | |
| SCHEMBL24432375 | 0.79 | IKBKB (0.46) | CYP1A2CYP3A4HPGDKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9397300-B2 | Compound and organic light-emitting diode including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-07-19 | — | — | US | disclosed |
| US-20140225070-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2014-08-14 | — | — | US | disclosed |