Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzil SCHEMBL1923895 | 0.81 | CES2 (0.54) | PGRADRA2AADRA2BHTR2AHRH1 | |
| Acetophenone SCHEMBL6684394 | 0.80 | LMNA (0.47) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL10384796 | 0.79 | MEN1 (0.40) | SRCPGRADRA2AADRA2BHTR2A | |
| SCHEMBL27580806 | 0.79 | POLB (0.52) | SRCSMN1; SMN2MEN1NPC1KMT2A | |
| SCHEMBL637241 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 | |
| SCHEMBL7684 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 | |
| SCHEMBL31097912 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 | |
| SCHEMBL414466 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 | |
| SCHEMBL32681153 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 | |
| SCHEMBL2904552 | 0.78 | CES1 (0.58) | SRCSMN1; SMN2MEN1KMT2ACES1 |
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-2005103035-A1 | MODIFIED FISCHER INDOLE SYNTHESIS OF ELETRIPTAN | PFIZER LIMITED (GB) | 2005-11-03 | — | — | WO | disclosed |