Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 12/20 | 0.70 |
| ▸ | HTR1B | P28222 | 2/20 | 0.64 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.59 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | DRD4 | P21917 | 2/20 | 0.59 |
| ▸ | DRD3 | P35462 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | THRB | P10828 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL6239357 | 1.00 | HTR1A (0.70) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL28129084 | 0.87 | HTR1A (0.62) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL10472395 | 0.85 | HTR1A (0.69) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL17286567 | 0.84 | HTR1B (0.66) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL9700629 | 0.81 | HTR1B (0.46) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3799623 | 0.80 | HTR1B (0.64) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL10591827 | 0.78 | HTR1B (0.58) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL3798923 | 0.78 | HTR1B (0.62) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL5759097 | 0.78 | HTR1A (0.71) | HTR1AHTR1BADRB2ADRB1CYP1A2 | |
| SCHEMBL1545429 | 0.76 | HTR1B (0.60) | HTR1AHTR1BADRB2ADRB1CYP1A2 |
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-2005023196-A2 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-03-17 | — | — | WO | disclosed |