Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.50 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | EDNRA | P25101 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CLK1 | P49759 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868477 | 0.84 | MCL1 (0.43) | MCL1GPR35HPGDKDM4EL3MBTL1 | |
| SCHEMBL3611742 | 0.76 | MAPT (0.65) | MCL1GPR35HPGDKDM4EEDNRA | |
| SCHEMBL11014893 | 0.76 | ESR2 (0.36) | MCL1HPGDKDM4EL3MBTL1NPC1 | |
| SCHEMBL17843607 | 0.76 | MCL1 (0.61) | MCL1GPR35HPGDKDM4EL3MBTL1 | |
| SCHEMBL10743549 | 0.75 | RAB9A (0.51) | HPGDEDNRAALDH1A1NPC1MAPT | |
| SCHEMBL73704 | 0.73 | RAB9A (0.56) | KDM4EL3MBTL1ALDH1A1HSD17B10NPC1 | |
| SCHEMBL11748571 | 0.68 | MCL1 (0.51) | MCL1GPR35HPGDKDM4EL3MBTL1 | |
| SCHEMBL10738263 | 0.68 | KDM4E (0.47) | MCL1HPGDKDM4EL3MBTL1EDNRA | |
| SCHEMBL10459819 | 0.68 | MCL1 (0.56) | MCL1GPR35HPGDKDM4EL3MBTL1 | |
| SCHEMBL1356879 | 0.67 | CYP1A2 (0.55) | MCL1GPR35HPGDKDM4EL3MBTL1 |
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-4663347-A | ANTIINFLAMMATORY, ANTIALLERGENS, CARDIOVASCULAR | MERCK FROSST CANADA, INC. (CA) | 1987-05-05 | — | — | US | disclosed |
| EP-0146243-A1 | Lipoxygenase inhibitors | MERCK FROSST CANADA INC. (CA) | 1985-06-26 | — | — | EP | disclosed |