Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.32 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.32 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL17265411 | 0.97 | MAPK1 (0.36) | CA12CA1CA2CA9MAPK1 | |
| SCHEMBL17265409 | 0.86 | ALOX5 (0.34) | MAPK1KDM4EATMALDH1A1HPGD | |
| SCHEMBL17265394 | 0.86 | MAPK1 (0.38) | MAPK1KDM4EATMALDH1A1HPGD | |
| SCHEMBL17265386 | 0.84 | CA12 (0.38) | CA12CA1CA2CA9MAPK1 | |
| SCHEMBL17265418 | 0.82 | — | — | |
| SCHEMBL16376371 | 0.82 | MAPK1 (0.39) | MAPK1KDM4EATMALDH1A1HPGD | |
| SCHEMBL18012342 | 0.81 | MAPK1 (0.50) | CA12CA1CA2CA9MAPK1 | |
| SCHEMBL17265382 | 0.81 | KDM4E (0.36) | CA12CA1CA2CA9MAPK1 | |
| SCHEMBL17265381 | 0.81 | — | — | |
| SCHEMBL17265385 | 0.80 | CYP11B1 (0.44) | CA12CA1CA2CA9MAPK1 |
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-9711736-B2 | Condensed cyclic compound and organic light-emitting device comprising the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-07-18 | — | — | US | disclosed |
| US-20150333268-A1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-11-19 | — | — | US | disclosed |