Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.47 |
| ▸ | HTR6 | P50406 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.44 |
| ▸ | HTR7 | P34969 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | HTR5A | P47898 | 2/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.44 |
| ▸ | HTR3B | O95264 | 2/20 | 0.44 |
| ▸ | HTR3A | P46098 | 2/20 | 0.44 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.44 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL531748 | 0.85 | ADRB1 (0.62) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| SCHEMBL31321556 | 0.85 | ADRB1 (0.62) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| Hydrochloric Acid SCHEMBL9040625 | 0.84 | ADRB1 (0.60) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| Hydrochloric Acid SCHEMBL6237151 | 0.84 | ADRB1 (0.60) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| Bromide SCHEMBL4322614 | 0.84 | ADRB1 (0.60) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| SCHEMBL7991421 | 0.75 | PIM1 (0.48) | ADRB1HTR6SIGMAR1HTR3EHTR3B | |
| SCHEMBL7979096 | 0.74 | ADRB1 (0.53) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| Tert-Butyl Formate SCHEMBL27974539 | 0.72 | ADRB1 (0.47) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| SCHEMBL3626941 | 0.72 | ADRB1 (0.69) | ADRB1HTR6HTR2ASIGMAR1HTR7 | |
| SCHEMBL11120307 | 0.72 | GAA (0.70) | DRD4LMNAGAAHTTALDH1A1 |
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-2001074762-A2 | ARYLSULFATES AND THEIR USE AS ENHANCERS OR INHIBITORS OF BIOADHESION TO SURFACES | PHYCOGEN, INC. (US) | 2001-10-11 | — | — | WO | disclosed |