Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CYBB | P04839 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | SNCA | P37840 | 1/20 | 0.42 |
| ▸ | NOX3 | Q9HBY0 | 1/20 | 0.42 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.42 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL261191 | 0.88 | BACE1 (0.44) | CALCRLBACE1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL16661410 | 0.86 | LMNA (0.49) | CALCRLBACE1MAPTSMN1; SMN2KMT2A | |
| SCHEMBL12622656 | 0.86 | BACE1 (0.41) | CALCRLBACE1MAPTSMN1; SMN2PDK2 | |
| SCHEMBL12655442 | 0.86 | SMN1; SMN2 (0.45) | CALCRLBACE1MAPTSMN1; SMN2PDK2 | |
| SCHEMBL16658941 | 0.85 | SMN1; SMN2 (0.44) | CALCRLBACE1MAPTSMN1; SMN2PDK2 | |
| SCHEMBL16471989 | 0.82 | IP6K1 (0.41) | CALCRLPGRMAPTNPC1RAB9A | |
| SCHEMBL16472010 | 0.82 | IP6K1 (0.43) | CALCRLPGRMAPTNPC1RAB9A | |
| SCHEMBL16472011 | 0.81 | CALCRL (0.41) | CALCRLPGRMAPTNPC1RAB9A | |
| SCHEMBL9774481 | 0.81 | BACE1 (0.57) | BACE1NPC1MEN1GAAKMT2A | |
| SCHEMBL1700260 | 0.80 | BACE1 (0.48) | CALCRLBACE1MAPTSMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1912653-B1 | HETEROCYCLIC BENZODIAZEPINE CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (US) | 2014-01-01 | — | — | EP | disclosed |