Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CHKA | P35790 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL14544222 | 0.88 | KCNH2 (0.44) | KCNH2NR1H4ACHEBCHELMNA | |
| SCHEMBL12752952 | 0.88 | KCNH2 (0.44) | KCNH2NR1H4ACHEBCHELMNA | |
| SCHEMBL1134090 | 0.85 | TSHR (0.50) | KCNH2NR1H4ACHEBCHELMNA | |
| SCHEMBL338386 | 0.85 | BCHE (0.52) | KCNH2ACHEBCHELMNATSHR | |
| SCHEMBL17485895 | 0.85 | CHKA (0.47) | CHKATSHRTP53EGFRTUBB4A | |
| SCHEMBL15960800 | 0.83 | SIGMAR1 (0.41) | KCNH2ACHEBCHELMNACHKA | |
| SCHEMBL12752953 | 0.82 | KIF11 (0.44) | KCNH2NR1H4ACHEBCHELMNA | |
| SCHEMBL12027373 | 0.82 | KIF11 (0.44) | KCNH2NR1H4ACHEBCHELMNA | |
| SCHEMBL24145271 | 0.79 | KIF11 (0.52) | KCNH2LMNATSHRHTR1DADRA1A | |
| SCHEMBL18643754 | 0.79 | KIF11 (0.52) | KCNH2ACHEBCHELMNATSHR |
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-2020217229-A1 | POLYCYCLIC COMPOUND AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE POLYCYCLIC COMPOUND OR THE COMPOSITION | IDEMITSU KOSAN CO., LTD. (JP) | 2020-10-29 | — | — | WO | disclosed |