Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10811800 | 0.95 | CYP2D6 (0.39) | CYP2D6HTR2ATHRATHRBCNR1 | |
| SCHEMBL10808281 | 0.95 | CYP2D6 (0.42) | CYP2D6HTR2ATHRATHRBCNR1 | |
| SCHEMBL10807823 | 0.93 | THRA (0.39) | CYP2D6HTR2ATHRATHRBLTB4R | |
| SCHEMBL10804827 | 0.89 | ADRB2 (0.39) | CYP2D6HTR2ATHRATHRBADRB2 | |
| SCHEMBL10804135 | 0.88 | THRA (0.39) | CYP2D6HTR2ATHRATHRBLTB4R | |
| SCHEMBL10804028 | 0.88 | THRA (0.39) | THRATHRBCNR1CNR2LTB4R | |
| SCHEMBL10803365 | 0.88 | THRA (0.39) | THRATHRBCNR1CNR2LTB4R | |
| SCHEMBL10808605 | 0.88 | THRA (0.41) | THRATHRB | |
| SCHEMBL10810598 | 0.88 | THRA (0.41) | THRATHRB | |
| SCHEMBL10808544 | 0.87 | LTB4R (0.38) | THRATHRBCNR1CNR2LTB4R |
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 |
|---|---|---|---|---|---|---|---|
| US-4640913-A | Phosphocholine derivatives having antihypertensive action | AMERICAN CYANAMID COMPANY (US) | 1987-02-03 | — | — | US | disclosed |