Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 5/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 10/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.42 |
| ▸ | SMO | Q99835 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6540024 | 1.00 | BACE1 (0.53) | BACE1ADRB3ITGB1ITGA4SMO | |
| SCHEMBL6539651 | 0.89 | ADRB3 (0.47) | BACE1ADRB3SMOADRB1ADRB2 | |
| SCHEMBL6539659 | 0.89 | ADRB3 (0.47) | BACE1ADRB3SMOADRB1ADRB2 | |
| SCHEMBL6539237 | 0.82 | BACE1 (0.52) | BACE1ADRB3ITGB1ITGA4ADRB1 | |
| SCHEMBL6539232 | 0.82 | BACE1 (0.52) | BACE1ADRB3ITGB1ITGA4ADRB1 | |
| SCHEMBL6539195 | 0.79 | BACE1 (0.54) | BACE1ADRB3ADRB1ADRB2ADRA1D | |
| SCHEMBL6538940 | 0.79 | BACE1 (0.54) | BACE1ADRB3ADRB1ADRB2ADRA1D | |
| SCHEMBL6538935 | 0.79 | BACE1 (0.54) | BACE1ADRB3ADRB1ADRB2ADRA1D | |
| SCHEMBL6478726 | 0.74 | BACE1 (0.52) | BACE1ADRB3ADRB1ADRB2ADRA1D | |
| SCHEMBL6478721 | 0.74 | BACE1 (0.52) | BACE1ADRB3ADRB1ADRB2ADRA1D |
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-6826033-B2 | BETA 3 ADRENERGIC RECEPTOR AGONISTS; TREATMENT OF POLLAKIURIA, URINARY INCONTINENCE, OBESITY OR DIABETES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-11-30 | — | — | US | disclosed |
| US-20040037022-A1 | Aminoalcohol derivatives | ASTELLAS PHARMA INC. (JP) | 2004-02-26 | — | — | US | disclosed |