Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 3/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | F7 | P08709 | 1/20 | 0.38 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6676768 | 1.00 | ADRB1 (0.43) | ADRB1ADRB3AKR1C3ALDH1A1LMNA | |
| SCHEMBL6677349 | 0.95 | ACACB (0.45) | ADRB1ADRB3AKR1C3ALDH1A1LMNA | |
| SCHEMBL6677355 | 0.95 | ACACB (0.45) | ADRB1ADRB3AKR1C3ALDH1A1LMNA | |
| SCHEMBL6804630 | 0.89 | ACACB (0.48) | ADRB1ALDH1A1LMNASMN1; SMN2ACACB | |
| SCHEMBL6541155 | 0.86 | MTNR1A (0.48) | ACACBESR1KCNH2 | |
| SCHEMBL6676699 | 0.86 | MTNR1A (0.48) | ACACBESR1KCNH2 | |
| SCHEMBL6805223 | 0.84 | ACACB (0.48) | ADRB1ALDH1A1LMNASMN1; SMN2ACACB | |
| SCHEMBL6804634 | 0.84 | ACACB (0.39) | LMNAACACBESR1KCNH2SLC6A4 | |
| SCHEMBL6804635 | 0.84 | ACACB (0.39) | LMNAACACBESR1KCNH2SLC6A4 | |
| SCHEMBL6676495 | 0.83 | ALDH1A1 (0.47) | ADRB1ADRB3AKR1C3ALDH1A1LMNA |
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-2004045610-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD (JP) | 2004-06-03 | — | — | WO | disclosed |