Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | PTPN22 | Q9Y2R2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 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 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL9206648 | 1.00 | ALDH1A1 (0.33) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9205692 | 0.86 | ALDH1A1 (0.33) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9205687 | 0.86 | ALDH1A1 (0.33) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9207972 | 0.77 | GPR84 (0.42) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9207977 | 0.77 | GPR84 (0.42) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9210375 | 0.72 | GPR3 (0.37) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9210378 | 0.72 | GPR3 (0.37) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL111535 | 0.72 | — | — | |
| SCHEMBL9212724 | 0.71 | LMNA (0.34) | ALDH1A1KDM4EMAPTHPGDPTPN22 | |
| SCHEMBL9215695 | 0.69 | ALDH1A1 (0.35) | ALDH1A1KDM4EMAPTHPGDPTPN22 |
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 |