Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 3/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL9782109 | 0.96 | THRA (0.38) | THRAKCNA5CYP51A1BCHEADRB3 | |
| SCHEMBL9782286 | 0.84 | CYP51A1 (0.41) | THRACYP51A1ALDH1A1FFAR1HRH3 | |
| SCHEMBL9782603 | 0.84 | CYP51A1 (0.37) | THRACYP51A1ADRB3ALDH1A1FFAR1 | |
| SCHEMBL9814028 | 0.84 | MEN1 (0.48) | THRACYP51A1BCHEADRB3ALDH1A1 | |
| SCHEMBL9782553 | 0.82 | MAOB (0.42) | THRAKCNA5FFAR1 | |
| SCHEMBL9782289 | 0.81 | CYP51A1 (0.57) | CYP51A1ADRB3 | |
| SCHEMBL9782133 | 0.81 | KCNH2 (0.38) | THRACYP51A1BCHEADRB3ALDH1A1 | |
| SCHEMBL9782152 | 0.80 | ADRB3 (0.54) | ADRB3ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL9782089 | 0.79 | OPRK1 (0.43) | KCNA5CYP51A1BCHEKDM4EKCNH2 | |
| SCHEMBL9813873 | 0.77 | ADRB3 (0.48) | CYP51A1ADRB3CYP1A2CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4988714-A | Drugs for treatment of obesity and diabetics, increases protein breakdown, for fattening animals | HOFFMANN-LA ROCHE INC. (US) | 1991-01-29 | — | — | US | disclosed |
| US-4800206-A | ANTIDIABETIC AGENTS; HYPOGLYCEMIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1989-01-24 | — | — | US | disclosed |