Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.33 |
| ▸ | TSPO | P30536 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.30 |
| ▸ | TUBB | P07437 | 1/20 | 0.30 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.30 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.30 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.30 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.30 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.30 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18963079 | 0.98 | CA12 (0.33) | CA12CA1CA2CA9ALK | |
| SCHEMBL25671868 | 0.95 | CA12 (0.37) | CA12CA1CA2CA9ALK | |
| SCHEMBL23370376 | 0.95 | CA12 (0.34) | CA12CA1CA2CA9ALK | |
| SCHEMBL17209210 | 0.93 | CA12 (0.38) | CA12CA1CA2CA9ALK | |
| SCHEMBL18963078 | 0.93 | KDM4E (0.38) | KDM4EATML3MBTL1TSPOHDAC4 | |
| SCHEMBL22173294 | 0.93 | KDM4E (0.38) | KDM4EATML3MBTL1TSPOHDAC4 | |
| SCHEMBL17209208 | 0.93 | CA12 (0.38) | CA12CA1CA2CA9ALK | |
| SCHEMBL23370591 | 0.92 | ALK (0.33) | CA12CA1CA2CA9ALK | |
| SCHEMBL17209187 | 0.92 | CA12 (0.39) | CA12CA1CA2CA9ALK | |
| SCHEMBL23370587 | 0.92 | L3MBTL1 (0.40) | KDM4EATML3MBTL1TSPOHDAC4 |
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-2017099490-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME | 희성소재(주) | 2017-06-15 | — | — | WO | disclosed |