Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21180348 | 1.00 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177738 | 0.83 | CHRM2 (0.38) | ALDH1A1CYP3A4ALOX12CA1CA2 | |
| SCHEMBL21177740 | 0.83 | CHRM2 (0.38) | ALDH1A1CYP3A4ALOX12CA1CA2 | |
| SCHEMBL21177858 | 0.79 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177725 | 0.79 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177551 | 0.78 | LTA4H (0.42) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177737 | 0.78 | LTA4H (0.42) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177863 | 0.76 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177862 | 0.76 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 | |
| SCHEMBL21177855 | 0.75 | LTA4H (0.42) | ALDH1A1SMN1; SMN2CYP3A4TSHRTP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019143142-A1 | NOVEL PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING GLIOBLASTOMA | 숙명여자대학교 산학협력단 | 2019-07-25 | — | — | WO | claimed |
| WO-2019143143-A1 | PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING NEUROBLASTOMA OR RHEUMATOID ARTHRITIS | 숙명여자대학교 산학협력단 | 2019-07-25 | — | — | WO | claimed |
| WO-2019143142-A1 | NOVEL PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING GLIOBLASTOMA | 숙명여자대학교 산학협력단 | 2019-07-25 | — | — | WO | disclosed |
| WO-2019143143-A1 | PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING NEUROBLASTOMA OR RHEUMATOID ARTHRITIS | 숙명여자대학교 산학협력단 | 2019-07-25 | — | — | WO | disclosed |