Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PHGDH | O43175 | 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 | |
|---|---|---|---|---|
| SCHEMBL13601690 | 0.91 | MAPT (0.44) | MAPTGAAALDH1A1NPC1CHRM2 | |
| SCHEMBL13601676 | 0.83 | MAPT (0.53) | MAPTGAAALDH1A1NPC1HPGD | |
| SCHEMBL8262857 | 0.83 | ALDH1A1 (0.44) | GAAALDH1A1NPC1CHRM2CHRM4 | |
| SCHEMBL12881480 | 0.83 | MAPT (0.43) | MAPTGAAALDH1A1CHRM2CHRM4 | |
| SCHEMBL13601727 | 0.82 | CHRM2 (0.43) | MAPTGAAALDH1A1NPC1CHRM2 | |
| SCHEMBL13601680 | 0.81 | HPGD (0.56) | MAPTGAAALDH1A1NPC1HPGD | |
| SCHEMBL12881488 | 0.80 | ACHE (0.43) | MAPTGAACHRM2CHRM4CHRM5 | |
| SCHEMBL13601675 | 0.80 | MAPT (0.70) | MAPTGAAALDH1A1NPC1HPGD | |
| SCHEMBL13601702 | 0.79 | MAPT (0.49) | MAPTGAAALDH1A1NPC1HPGD | |
| SCHEMBL12881497 | 0.79 | L3MBTL1 (0.44) | MAPTGAAALDH1A1CHRM2CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| US-7625886-B2 | Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-12-01 | — | — | US | disclosed |
| US-7625886-B2 | Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-12-01 | — | — | US | disclosed |