Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 3/20 | 0.34 |
| ▸ | NR2E1 | Q9Y466 | 3/20 | 0.34 |
| ▸ | HTR2A | P28223 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR6 | P50406 | 3/20 | 0.34 |
| ▸ | SCN1A | P35498 | 2/20 | 0.34 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14260258 | 0.81 | KDM4E (0.38) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL14260234 | 0.81 | LMNA (0.34) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL13392162 | 0.81 | LMNA (0.40) | ALDH1A1KDM4EKMT2ALMNASLC6A4 | |
| SCHEMBL764155 | 0.81 | ADRB2 (0.46) | ALDH1A1KDM4ELMNAADRB2ADRB1 | |
| SCHEMBL765338 | 0.80 | LMNA (0.39) | ALDH1A1KDM4EKMT2ALMNASLC6A4 | |
| SCHEMBL13392155 | 0.72 | LMNA (0.39) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL10150236 | 0.72 | LMNA (0.39) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL13894250 | 0.71 | LMNA (0.55) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL14260232 | 0.67 | LMNA (0.34) | ALDH1A1KDM4EKMT2ALMNAADRB2 | |
| SCHEMBL28634561 | 0.66 | LMNA (0.52) | KMT2ALMNAADRB2ADRB1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2431380-A2 | Macrocyclic antagonist of the motilin receptor for treatment of gastrointestinal dysmotility disorders | Tranzyme Pharma, Inc. (US) | 2012-03-21 | — | — | EP | disclosed |
| WO-2008033328-A2 | MACROCYCLIC ANTAGONISTS OF THE MOTILIN RECEPTOR FOR TREATMENT OF GASTROINTESTINAL DYSMOTILITY DISORDERS | TRANZYME PHARMA, INC. (US) | 2008-03-20 | — | — | WO | disclosed |