Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 5/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27907595 | 0.84 | HDAC4 (0.45) | OPRM1HDAC4TSHRACHEALDH1A1 | |
| SCHEMBL10229942 | 0.83 | OPRM1 (0.37) | OPRM1SIGMAR1HTR2CBACE1TSHR | |
| SCHEMBL17219889 | 0.79 | HDAC4 (0.38) | OPRM1HDAC4TSHRACHEALDH1A1 | |
| SCHEMBL9650053 | 0.79 | SIGMAR1 (0.60) | OPRM1SIGMAR1HTR2CADRB1DRD2 | |
| SCHEMBL5635581 | 0.74 | OPRM1 (0.55) | OPRM1SIGMAR1TSHRALDH1A1HTR2A | |
| SCHEMBL23333488 | 0.74 | OPRM1 (0.57) | OPRM1SIGMAR1HDAC4HTR2CADRB1 | |
| SCHEMBL8040967 | 0.73 | OPRM1 (0.56) | OPRM1SIGMAR1HDAC4HTR2CADRB1 | |
| SCHEMBL2270935 | 0.73 | SIGMAR1 (0.62) | OPRM1SIGMAR1HDAC4HTR2CADRB1 | |
| SCHEMBL4076354 | 0.72 | SIGMAR1 (0.49) | SIGMAR1HTR2CADRB1TSHRALDH1A1 | |
| Bromide SCHEMBL10922384 | 0.71 | OPRM1 (0.52) | OPRM1SIGMAR1TSHRALDH1A1HTR2A |
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-5169096-A | Serotonin antagonists, analgesics | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-12-08 | — | — | US | disclosed |
| US-5021428-A | Novel chemical compounds for the prophylactic treatment of migraine | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-06-04 | — | — | US | disclosed |
| US-4912117-A | Therapy for varient angina | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-03-27 | — | — | US | disclosed |
| US-4783471-A | N-aralkyl piperidine methanol derivatives and the uses thereof | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-11-08 | — | — | US | disclosed |
| EP-0208235-A1 | N-Aralkyl piperidinemethanol derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-01-14 | — | — | EP | disclosed |