Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | DDO | Q99489 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4915245 | 0.81 | MCL1 (0.37) | MCL1GPR35ESR1ESR2ALOX15 | |
| SCHEMBL4915797 | 0.81 | MCL1 (0.37) | MCL1GPR35ESR1ESR2ALOX15 | |
| SCHEMBL4911364 | 0.81 | MCL1 (0.37) | MCL1GPR35ESR1ESR2ALOX15 | |
| SCHEMBL4924926 | 0.77 | MCL1 (0.43) | MCL1ALOX15ALOX12KDM4EMAPT | |
| SCHEMBL4920269 | 0.77 | ESR2 (0.39) | MCL1ESR1ESR2ALOX15KDM4E | |
| SCHEMBL4913506 | 0.77 | MCL1 (0.35) | MCL1GPR35ESR1ESR2ALOX15 | |
| SCHEMBL18706935 | 0.76 | NOS3 (0.36) | MCL1MAPK1GAAGABRA1GABRB2 | |
| SCHEMBL1760478 | 0.75 | ALOX15 (0.54) | MCL1ESR1ESR2ALOX15ALOX12 | |
| SCHEMBL18388796 | 0.74 | AR (0.36) | ALOX15MAPTALDH1A1HSD17B10HPGD | |
| SCHEMBL3885414 | 0.73 | GPR35 (0.48) | GPR35MAPTALDH1A1HPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3119770-B1 | NEW DIBENZOFURANS AND DIBENZOTHIOPHENES | IDEMITSU KOSAN CO (JP) | 2018-05-02 | — | — | EP | disclosed |