Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 8/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.38 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6406680 | 0.96 | MTNR1B (0.47) | MTNR1BADRA1ACNR1CNR2ALDH1A1 | |
| SCHEMBL6409730 | 0.80 | CNR1 (0.54) | CNR1CNR2 | |
| SCHEMBL6406808 | 0.77 | CNR2 (0.51) | CNR1CNR2 | |
| SCHEMBL6405341 | 0.73 | MTNR1B (0.50) | MTNR1B | |
| SCHEMBL6403876 | 0.72 | ADRA1D (0.46) | MTNR1BADRA1ACNR1CNR2HRH3 | |
| SCHEMBL6405239 | 0.68 | MTNR1B (0.55) | MTNR1BCNR1CNR2ALOX15HSD17B10 | |
| SCHEMBL6404873 | 0.67 | MTNR1B (0.52) | MTNR1BCNR1CNR2ALDH1A1MTNR1A | |
| SCHEMBL6001623 | 0.67 | MTNR1B (0.70) | MTNR1BMTNR1A | |
| SCHEMBL22411069 | 0.66 | MTNR1B (0.51) | MTNR1BCNR1CNR2ALDH1A1KDM4E | |
| SCHEMBL6403250 | 0.66 | MTNR1B (0.48) | MTNR1BCNR1CNR2MTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005113527-A1 | TETRAHYDRONAPHTHYL- PIPERAZINES AS 5-HT1B ANTAGONISTS, INVERSE AGONISTS AND PARTIAL AGONISTS | PFIZER PRODUCTS INC. (US) | 2005-12-01 | — | — | WO | disclosed |