Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.57 |
| ▸ | DRD3 | P35462 | 10/20 | 0.57 |
| ▸ | DRD4 | P21917 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.56 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5628955 | 0.99 | DRD2 (0.56) | DRD2DRD3DRD4MEN1KMT2A | |
| SCHEMBL4622647 | 0.82 | CYP19A1 (0.56) | DRD2DRD3DRD4CYP19A1OPRK1 | |
| Hydrochloric Acid SCHEMBL4622734 | 0.81 | CYP19A1 (0.55) | DRD2DRD3DRD4CYP19A1OPRK1 | |
| SCHEMBL6156864 | 0.81 | CYP19A1 (0.57) | DRD2DRD3DRD4MEN1KMT2A | |
| SCHEMBL25819850 | 0.81 | DRD2 (0.64) | DRD2DRD3HTR1ACYP19A1 | |
| SCHEMBL4621043 | 0.81 | CYP19A1 (0.54) | DRD2DRD3DRD4MEN1KMT2A | |
| SCHEMBL630379 | 0.81 | CYP19A1 (0.60) | DRD2DRD3DRD4MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4622640 | 0.80 | DRD2 (0.63) | DRD2DRD3DRD4CYP19A1CA1 | |
| SCHEMBL5582712 | 0.77 | CYP19A1 (0.53) | DRD2DRD3DRD4MEN1KMT2A | |
| SCHEMBL4621898 | 0.77 | CYP19A1 (0.53) | DRD2DRD3DRD4MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0971878-B1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2008-03-26 | — | — | EP | disclosed |
| EP-0971878-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2000-01-19 | — | — | EP | disclosed |
| WO-1998038156-A1 | AMINE COMPOUNDS, THEIR PRODUCTION AND USE AS AMYLOID-BETA PRODUCTION INHIBITORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-03 | — | — | WO | disclosed |