Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.44 |
| ▸ | PDE4A | P27815 | 4/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| 4-Methylbenzoic Acid SCHEMBL7798453 | 0.91 | KDM4E (0.46) | SMN1; SMN2KDM4ETDP1ATMALDH1A1 | |
| SCHEMBL7792606 | 0.90 | KDM4E (0.45) | SMN1; SMN2KDM4ETDP1ATMRXRA | |
| SCHEMBL8035858 | 0.89 | MAOB (0.46) | KDM4ETDP1RXRARXRBRXRG | |
| SCHEMBL8035116 | 0.87 | PTGES (0.48) | KDM4ETDP1RXRARXRBRXRG | |
| Phenethylamine SCHEMBL7799179 | 0.86 | RXRA (0.52) | KDM4ERXRARXRBRXRGALDH1A1 | |
| SCHEMBL7798806 | 0.86 | KDM4E (0.60) | KDM4ETDP1ATMCYP3A4ALDH1A1 | |
| Tyramine SCHEMBL8035895 | 0.84 | RXRA (0.48) | KDM4ERXRARXRBRXRGALDH1A1 | |
| SCHEMBL7798437 | 0.84 | SRD5A2 (0.47) | RXRARXRBRXRG | |
| SCHEMBL7802656 | 0.84 | RXRA (0.47) | ATMRXRARXRBRXRGALDH1A1 | |
| SCHEMBL7802496 | 0.83 | RXRA (0.46) | SMN1; SMN2RXRARXRBRXRGMAPT |
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 |