Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAT2A | P31153 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 2/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26923116 | 0.81 | MTNR1A (0.41) | MTNR1AMTNR1BPTPN11BRD4CREBBP | |
| Cyanide SCHEMBL27780629 | 0.77 | MTNR1A (0.39) | MTNR1AMTNR1B | |
| SCHEMBL543688 | 0.76 | MTNR1A (0.38) | MTNR1AMTNR1BPTPN11MAOAMAOB | |
| SCHEMBL543364 | 0.76 | HTR2C (0.49) | — | |
| SCHEMBL543689 | 0.76 | MTNR1A (0.38) | MTNR1AMTNR1BPTPN11MAOAMAOB | |
| SCHEMBL543365 | 0.76 | HTR2C (0.49) | — | |
| SCHEMBL543148 | 0.75 | MTNR1A (0.40) | MTNR1AMTNR1BMAOAMAOB | |
| Hydrochloric Acid SCHEMBL543471 | 0.75 | HTR2C (0.51) | — | |
| Hydrochloric Acid SCHEMBL543472 | 0.75 | HTR2C (0.51) | — | |
| SCHEMBL27228540 | 0.73 | MAOA (0.36) | MTNR1AMTNR1BPTPN11MAOAMAOB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2141150-A1 | BICYCLIC COMPOUND AND PHARMACEUTICAL USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-01-06 | — | — | EP | disclosed |