Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | HASPIN | Q8TF76 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9765119 | 0.88 | CA2 (0.39) | CYP19A1ADRB2CA2HTR1DHTR2A | |
| SCHEMBL9800340 | 0.84 | HTR1D (0.54) | ADRB2CA2HTR1DRECQLENPP1 | |
| SCHEMBL9800394 | 0.82 | ADRB2 (0.41) | ADRB2CA2HTR1DRECQLENPP1 | |
| SCHEMBL9800377 | 0.81 | ADRB2 (0.46) | ADRB2CA2HTR1DRECQLENPP1 | |
| Hydrochloric Acid SCHEMBL9800411 | 0.81 | HTR6 (0.53) | CYP19A1ADRB2HTR1DHTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL9800409 | 0.81 | NQO2 (0.41) | CYP19A1ADRB2CA2HTR1DRECQL | |
| SCHEMBL9800333 | 0.81 | NQO2 (0.42) | ADRB2CA2HTR1DRECQLHTR2A | |
| SCHEMBL9800355 | 0.81 | HTR6 (0.55) | CYP19A1ADRB2HTR1DHTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL9800379 | 0.80 | HTR6 (0.54) | CYP19A1ADRB2HTR1DHTR2AHTR6 | |
| Hydrochloric Acid SCHEMBL27673725 | 0.80 | ADRB2 (0.39) | CYP19A1ADRB2CA2HTR1DRECQL |
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-4994483-A | 5-substituted-3-aminoalkyl indole derivatives for migraine | GLAXO GROUP LIMITED (GB) | 1991-02-19 | — | — | US | disclosed |