Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 6/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 6/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4278579 | 0.87 | KDM4E (0.44) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL43654 | 0.84 | ALDH1A1 (0.38) | THRBRECQLALDH1A1CA2CYP2D6 | |
| SCHEMBL15567040 | 0.69 | — | — | |
| SCHEMBL8964471 | 0.67 | FFAR3 (0.35) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL6970706 | 0.67 | FFAR3 (0.35) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL4981183 | 0.67 | FFAR3 (0.35) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL143910 | 0.67 | KDM4E (0.48) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL3430004 | 0.67 | KDM4E (0.48) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL25594806 | 0.67 | SMN1; SMN2 (0.48) | KDM4ENFKB1MAPTTHRBALOX15 | |
| SCHEMBL14157901 | 0.65 | TRPV1 (0.46) | KDM4ENFKB1MAPTTHRBALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113557017-A | Inhibitors of cyclin-dependent kinase 7 and uses thereof | 达纳-法伯癌症研究所股份有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-111479806-A | D-amino acid oxidase inhibitors and therapeutic uses thereof | 心悦生医股份有限公司 | 2020-07-31 | — | — | CN | disclosed |