Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6677349 | 1.00 | ACACB (0.45) | ACACBNPC1POLBCYP2C9RAB9A | |
| SCHEMBL6676768 | 0.95 | ADRB1 (0.43) | ACACBNPC1POLBCYP2C9RAB9A | |
| SCHEMBL6676771 | 0.95 | ADRB1 (0.43) | ACACBNPC1POLBCYP2C9RAB9A | |
| SCHEMBL6805223 | 0.89 | ACACB (0.48) | ACACBCYP2C9ADRB1ALDH1A1LMNA | |
| SCHEMBL6676495 | 0.87 | ALDH1A1 (0.47) | ACACBNPC1POLBCYP2C9RAB9A | |
| SCHEMBL6804630 | 0.84 | ACACB (0.48) | ACACBCYP2C9ADRB1ALDH1A1LMNA | |
| SCHEMBL6541155 | 0.81 | MTNR1A (0.48) | ACACBESR1KCNH2 | |
| SCHEMBL6676699 | 0.81 | MTNR1A (0.48) | ACACBESR1KCNH2 | |
| SCHEMBL6805228 | 0.80 | ACACB (0.43) | ACACBNPC1POLBRAB9AALDH1A1 | |
| SCHEMBL6805231 | 0.80 | ACACB (0.43) | ACACBNPC1POLBRAB9AALDH1A1 |
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 |