Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 4/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | AGER | Q15109 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.33 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.33 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.33 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9953863 | 0.77 | IDO1 (0.41) | LMNAALDH1A1SMN1; SMN2CES2CES1 | |
| SCHEMBL2399005 | 0.76 | KEAP1 (0.53) | ACHEKEAP1NFE2L2ALOX5LMNA | |
| SCHEMBL23554861 | 0.76 | CYP3A4 (0.41) | CHRNA7ACHEKEAP1NFE2L2TDP1 | |
| SCHEMBL28037840 | 0.74 | ACHE (0.44) | CHRNA7ACHEKEAP1NFE2L2TDP1 | |
| SCHEMBL371162 | 0.73 | ACHE (0.50) | CHRNA7ACHETDP1AGERALOX5 | |
| SCHEMBL2055581 | 0.73 | ACHE (0.50) | CHRNA7ACHETDP1AGERALOX5 | |
| SCHEMBL11861772 | 0.72 | KEAP1 (0.45) | ACHEKEAP1NFE2L2TDP1ALOX5 | |
| SCHEMBL14417193 | 0.70 | ACHE (0.47) | CHRNA7ACHEKEAP1NFE2L2TDP1 | |
| SCHEMBL17020102 | 0.70 | CHRNA7 (0.46) | CHRNA7ACHEKEAP1NFE2L2TDP1 | |
| SCHEMBL9732281 | 0.70 | CHRNA7 (0.46) | CHRNA7ACHEKEAP1NFE2L2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1076649-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 2001-02-21 | — | — | EP | claimed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | claimed |