Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | ALKBH5 | Q6P6C2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16619541 | 0.87 | ADRB3 (0.48) | LMNAHPGDHTTSMN1; SMN2KCNH2 | |
| SCHEMBL16619539 | 0.87 | ADRB3 (0.48) | LMNAHPGDHTTSMN1; SMN2KCNH2 | |
| SCHEMBL16619351 | 0.79 | ADRB3 (0.52) | KCNH2 | |
| SCHEMBL16619353 | 0.79 | ADRB3 (0.52) | KCNH2 | |
| SCHEMBL16619255 | 0.78 | ADRB3 (0.48) | KCNH2PDK1 | |
| SCHEMBL16619257 | 0.78 | ADRB3 (0.48) | KCNH2PDK1 | |
| SCHEMBL16629889 | 0.76 | PDK1 (0.47) | PDK1 | |
| SCHEMBL16629795 | 0.76 | ACACB (0.45) | HPGDPDK1NAMPT | |
| SCHEMBL16629839 | 0.75 | POLB (0.34) | LMNA | |
| SCHEMBL16630638 | 0.75 | PSEN1 (0.39) | PDK1 |
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-2015050798-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2015-04-09 | — | — | WO | disclosed |