Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 7/20 | 0.39 |
| ▸ | PPARA | Q07869 | 7/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL24029586 | 0.97 | MCL1 (0.46) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029720 | 0.95 | HPRT1 (0.42) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029643 | 0.95 | CA12 (0.47) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029661 | 0.94 | MCL1 (0.43) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029727 | 0.94 | CA12 (0.43) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029567 | 0.94 | HPRT1 (0.41) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029571 | 0.94 | MCL1 (0.40) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029530 | 0.94 | MCL1 (0.40) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL25730820 | 0.94 | HPRT1 (0.44) | MCL1ACMSDCA12CA1CA2 | |
| SCHEMBL24029572 | 0.93 | CA12 (0.42) | MCL1ACMSDCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021261907-A1 | ORGANIC LIGHT EMITTING DEVICE | 주식회사 엘지화학 | 2021-12-30 | — | — | WO | disclosed |
| WO-2021230715-A1 | ORGANIC LIGHT-EMITTING ELEMENT | 주식회사 엘지화학 | 2021-11-18 | — | — | WO | disclosed |