Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2 | P10415 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.43 |
| ▸ | CHKA | P35790 | 4/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | EDNRB | P24530 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17987004 | 1.00 | BCL2 (0.45) | BCL2TP53TAAR1CHKAKCNH2 | |
| SCHEMBL17986998 | 0.98 | BCL2 (0.46) | BCL2TP53TAAR1CHKAKCNH2 | |
| SCHEMBL13580186 | 0.92 | BCL2 (0.51) | BCL2TP53TAAR1CHKAPTGS2 | |
| SCHEMBL17987005 | 0.91 | TP53 (0.52) | BCL2TP53TAAR1CHKAKCNH2 | |
| SCHEMBL14011838 | 0.91 | TP53 (0.52) | BCL2TP53TAAR1CHKAKCNH2 | |
| SCHEMBL1702645 | 0.89 | TP53 (0.54) | TP53TAAR1CHKAKCNH2KDM4E | |
| SCHEMBL19826352 | 0.89 | TP53 (0.54) | TP53TAAR1CHKAKCNH2KDM4E | |
| SCHEMBL13855250 | 0.89 | TP53 (0.54) | BCL2TP53TAAR1CHKAKCNH2 | |
| SCHEMBL14650368 | 0.89 | TP53 (0.54) | TP53TAAR1CHKAKCNH2KDM4E | |
| SCHEMBL5008610 | 0.89 | TP53 (0.54) | BCL2TP53TAAR1CHKAKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160225998-A1 | CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2016-08-04 | — | — | US | disclosed |