Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 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 | |
|---|---|---|---|---|
| SCHEMBL20529619 | 1.00 | TSHR (0.40) | TSHRMAPTKCNH2MEN1KMT2A | |
| SCHEMBL16225988 | 0.73 | ACHE (0.51) | TSHRMAPTKCNH2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL5199132 | 0.72 | MMP2 (0.37) | TSHRMAPTLMNATP53SIGMAR1 | |
| SCHEMBL11399201 | 0.71 | P2RX7 (0.37) | KCNH2OPRM1DPP4DPP8DPP7 | |
| SCHEMBL23883211 | 0.71 | DRD2 (0.55) | TSHRKCNH2MEN1KMT2ACHRM2 | |
| SCHEMBL5820396 | 0.71 | DRD2 (0.55) | TSHRKCNH2MEN1KMT2ACHRM2 | |
| SCHEMBL10371232 | 0.71 | MEN1 (0.35) | TSHRMEN1KMT2ATP53 | |
| SCHEMBL27999842 | 0.68 | HTT (0.37) | MEN1KMT2AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL12513634 | 0.67 | SLC6A2 (0.54) | TSHRKCNH2MEN1KMT2AOPRM1 | |
| SCHEMBL67251 | 0.67 | CYP19A1 (0.41) | MEN1KMT2ANPSR1LMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2175724-A1 | METHODS AND COMPOSITIONS FOR TREATING SCHIZOPHRENIA USING ANTIPSYCHOTIC COMBINATION THERAPY | Medivation Neurology, Inc. (US) | 2010-04-21 | — | — | EP | disclosed |
| WO-2009017836-A1 | METHODS AND COMPOSITIONS FOR TREATING SCHIZOPHRENIA USING ANTIPSYCHOTIC COMBINATION THERAPY | MEDIVATION NEUROLOGY, INC. (US) | 2009-02-05 | — | — | WO | disclosed |
| EP-1565184-A1 | TREATMENT OF HEADACHE WITH ANTIPSYCHOTICS DELIVERED BY INHALATION | Alexza Molecular Delivery Corporation (US) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004047841-A1 | TREATMENT OF HEADACHE WITH ANTIPSYCHOTICS DELIVERED BY INHALATION | ALEXZA MOLECULAR DELIVERY CORPORATION (US) | 2004-06-10 | — | — | WO | disclosed |