Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.40 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.40 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.40 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 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 | |
|---|---|---|---|---|
| SCHEMBL10023308 | 0.91 | KDM4E (0.47) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL19500807 | 0.90 | MAPK10 (0.42) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL12699650 | 0.90 | KDM4E (0.48) | KDM4EATML3MBTL1TUBB4ATUBB | |
| SCHEMBL13957177 | 0.90 | KDM4E (0.52) | KDM4EATML3MBTL1ALDH1A1CYP2C9 | |
| SCHEMBL4406988 | 0.90 | KDM4E (0.52) | KDM4EATML3MBTL1ALDH1A1CYP2C9 | |
| SCHEMBL19130036 | 0.89 | PIK3CD (0.42) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL13829477 | 0.89 | CYP2A6 (0.46) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL26226195 | 0.89 | KDM4E (0.44) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL15040943 | 0.88 | CYP2A6 (0.48) | CYP2A6TDP1KDM4EATML3MBTL1 | |
| SCHEMBL14416318 | 0.88 | KDM4E (0.53) | KDM4EATML3MBTL1TUBB4ATUBB |
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-2017052138-A2 | AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2017-03-30 | — | — | WO | disclosed |