Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 6/20 | 0.53 |
| ▸ | GRIK2 | Q13002 | 6/20 | 0.53 |
| ▸ | SMPD2 | O60906 | 2/20 | 0.43 |
| ▸ | GRIK3 | Q13003 | 2/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9748809 | 1.00 | GRIK1 (0.53) | GRIK1GRIK2SMPD2GRIK3LDHA | |
| SCHEMBL1716930 | 0.74 | GRIK1 (0.65) | GRIK1GRIK2GRIK3 | |
| SCHEMBL1716932 | 0.74 | GRIK1 (0.65) | GRIK1GRIK2GRIK3 | |
| SCHEMBL9749492 | 0.74 | PPARG (0.46) | LDHA | |
| SCHEMBL9749139 | 0.74 | LDHA (0.45) | LDHACYP1B1ABCG2KDM4ECYP1A1 | |
| SCHEMBL9749134 | 0.74 | LDHA (0.45) | LDHACYP1B1ABCG2KDM4ECYP1A1 | |
| SCHEMBL9750303 | 0.74 | ALDH1A1 (0.45) | CYP1B1ABCG2KDM4EMEN1MAPT | |
| SCHEMBL9750296 | 0.74 | ALDH1A1 (0.45) | CYP1B1ABCG2KDM4EMEN1MAPT | |
| SCHEMBL765996 | 0.71 | CYP1B1 (0.54) | LDHACYP1B1ABCG2KDM4ECYP1A1 | |
| SCHEMBL765995 | 0.71 | CYP1B1 (0.54) | LDHACYP1B1ABCG2KDM4ECYP1A1 |
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-0201071-B1 | 2-SUBSTITUTED-1-NAPHTHOLS AS 5-LIPOXYGENASE INHIBITORS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1992-03-04 | — | — | EP | claimed |