Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 2/20 | 0.59 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.59 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9401037 | 0.77 | HTR1A (0.51) | DRD3DRD2DRD4HTR1AALDH1A1 | |
| Nitraquazone SCHEMBL125623 | 0.75 | PDE4A (1.00) | PDE4APDE4BPDE4DPDE4CKMT2A | |
| Nitraquazone SCHEMBL29424264 | 0.75 | PDE4A (1.00) | PDE4APDE4BPDE4DPDE4CKMT2A | |
| SCHEMBL9400889 | 0.74 | TSHR (0.52) | DRD3DRD2KDM4EALDH1A1MAPT | |
| SCHEMBL9400848 | 0.74 | TSHR (0.52) | ESR1HTR1AKDM4EALDH1A1MAPT | |
| SCHEMBL9401002 | 0.72 | TSHR (0.54) | ESR1HTR1AKDM4EALDH1A1MAPT | |
| SCHEMBL9401049 | 0.72 | TSHR (0.54) | DRD2ESR1HTR1AKDM4EALDH1A1 | |
| SCHEMBL9498106 | 0.72 | PDE4A (0.67) | PDE4APDE4BPDE4DPDE4CKMT2A | |
| SCHEMBL6979210 | 0.71 | PDE4A (0.55) | PDE4APDE4BPDE4DPDE4CKMT2A | |
| SCHEMBL11789479 | 0.71 | PDE4A (0.71) | PDE4APDE4BPDE4DPDE4CKMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5314884-A | Antidepressants, anxiolytic agents | TROPONWERKE GMBH & CO. (DE) | 1994-05-24 | — | — | US | disclosed |
| US-5187276-A | Anxiolytics, neuroleptics, antidepressants, and nootropic agents | TROPONWERKE GMBH & CO. KG. (DE) | 1993-02-16 | — | — | US | disclosed |
| US-4988809-A | CENTRAL NERVOUS SYSTEM | TROPONWERKE GMBH & CO., KG (DE) | 1991-01-29 | — | — | US | disclosed |
| US-4937343-A | NEUROLEPTICS OR ANTIDEPRESSANTS | TROPONWERKE GMBH & CO. KG (DE) | 1990-06-26 | — | — | US | disclosed |
| US-4818756-A | CENTRAL NERVOUS SYSTEM DISORDERS | TROPONWERKE GMBH & CO., KG (DE) | 1989-04-04 | — | — | US | disclosed |