Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC4 | O15439 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.39 |
| ▸ | GSR | P00390 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | MC5R | P33032 | 1/20 | 0.38 |
| ▸ | MC3R | P41968 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 3/20 | 0.36 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Phenylacetic Acid SCHEMBL7797965 | 1.00 | ABCC4 (0.43) | ABCC4LMNAGAATSHRPTGS1 | |
| Lysine SCHEMBL7800524 | 0.97 | GSR (0.43) | ABCC4LMNAGAATSHRPTGS1 | |
| Lysine SCHEMBL7800522 | 0.97 | GSR (0.43) | ABCC4LMNAGAATSHRPTGS1 | |
| Phenylacetic Acid SCHEMBL7798556 | 0.94 | PTGS1 (0.46) | ABCC4LMNAGAATSHRPTGS1 | |
| Ornithine SCHEMBL7792563 | 0.94 | GRIK1 (0.44) | PTGS1GRIK1GRIK2GSRMC4R | |
| Ornithine Aketoglutarate SCHEMBL7792564 | 0.94 | GRIK1 (0.44) | PTGS1GRIK1GRIK2GSRMC4R | |
| Ornithine SCHEMBL7792407 | 0.93 | GRIK1 (0.41) | PTGS1GRIK1GRIK2GSRMC4R | |
| Ornithine SCHEMBL7798279 | 0.93 | GRIK1 (0.43) | PTGS1GRIK1GRIK2GSRMC4R | |
| Ornithine Aketoglutarate SCHEMBL7798068 | 0.92 | GRIK1 (0.41) | PTGS1GRIK1GRIK2GSRMC4R | |
| Ornithine SCHEMBL7798070 | 0.92 | GRIK1 (0.41) | PTGS1GRIK1GRIK2GSRMC4R |
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 | disclosed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | disclosed |