Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 8/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL4027703 | 0.81 | SLC6A2 (0.71) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL11921529 | 0.68 | SLC6A2 (0.68) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL24352150 | 0.66 | HRH3 (0.35) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL4030851 | 0.65 | SLC6A2 (1.00) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL2568332 | 0.65 | SLC9A3 (0.67) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL11101484 | 0.64 | SLC6A2 (0.59) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL25452943 | 0.64 | ADRA2A (0.57) | LMNACYP1A2CYP2D6HTR2AADRA1A | |
| SCHEMBL22024397 | 0.64 | KIF11 (0.36) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 | |
| SCHEMBL16835251 | 0.64 | HTR2C (0.61) | MAPK1CYP1A2CYP3A4CYP2D6NFKB1 | |
| SCHEMBL4027936 | 0.64 | SLC6A2 (0.71) | SLC6A2SLC6A4SLC6A3LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4175191-A | 4-Phenyl isoquinolines | SANDOZ, INC. (US) | 1979-11-20 | — | — | US | disclosed |
| US-3989704-A | 3-Substituted-4-aryl isoquinolines | SANDOZ, INC. (US) | 1976-11-02 | — | — | US | disclosed |