Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | PTPN22 | Q9Y2R2 | 2/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PTPRC | P08575 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL9210375 | 1.00 | GPR3 (0.37) | GPR3HSD17B3PDK2S100A4HSD17B10 | |
| SCHEMBL9214381 | 0.88 | GPR3 (0.38) | GPR3HSD17B3PDK2S100A4HSD17B10 | |
| SCHEMBL9211137 | 0.88 | GPR3 (0.38) | GPR3HSD17B3PDK2S100A4HSD17B10 | |
| SCHEMBL9207977 | 0.81 | GPR84 (0.42) | HSD17B10ALDH1A1HPGDKDM4EMAPT | |
| SCHEMBL9207972 | 0.81 | GPR84 (0.42) | HSD17B10ALDH1A1HPGDKDM4EMAPT | |
| SCHEMBL9207295 | 0.79 | PTPRC (0.34) | PDK2HSD17B10ALDH1A1HPGDKDM4E | |
| SCHEMBL9207293 | 0.79 | PTPRC (0.34) | PDK2HSD17B10ALDH1A1HPGDKDM4E | |
| SCHEMBL9205324 | 0.76 | GPR3 (0.41) | GPR3PDK2ALDH1A1HPGDKDM4E | |
| SCHEMBL9205316 | 0.76 | GPR3 (0.41) | GPR3PDK2ALDH1A1HPGDKDM4E | |
| SCHEMBL9206644 | 0.72 | ALDH1A1 (0.33) | HSD17B10ALDH1A1HPGDKDM4EMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0319073-B1 | Cyclo-octane neuroprotective agents | MERCK SHARP & DOHME (GB) | 1995-08-23 | — | — | EP | disclosed |
| US-4927819-A | ANTICONVULSANT, PREVENTION OF NEURODEGENERATIVE DISORDERS | MERCK SHARP & DOHME LIMITED (GB) | 1990-05-22 | — | — | US | disclosed |
| EP-0319073-A2 | Cyclo-octane neuroprotective agents | MERCK SHARP & DOHME LTD. (GB) | 1989-06-07 | — | — | EP | disclosed |