Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13601727 | 0.90 | CHRM2 (0.43) | MAPTALDH1A1HTR1AGAACYP1A2 | |
| SCHEMBL12881477 | 0.88 | GNAI3 (0.42) | MAPTALDH1A1GAAL3MBTL1TSHR | |
| SCHEMBL12881484 | 0.88 | ACHE (0.41) | MAPTALDH1A1GAATDP1L3MBTL1 | |
| SCHEMBL12881494 | 0.87 | L3MBTL1 (0.42) | MAPTALDH1A1GAATDP1L3MBTL1 | |
| SCHEMBL13601690 | 0.83 | MAPT (0.44) | MAPTALDH1A1GAAL3MBTL1NPC1 | |
| SCHEMBL13601726 | 0.82 | SMN1; SMN2 (0.45) | MAPTALDH1A1HTR1AGAACYP1A2 | |
| SCHEMBL13601725 | 0.79 | TSHR (0.49) | MAPTALDH1A1HTR1AGAATSHR | |
| SCHEMBL12881480 | 0.79 | MAPT (0.43) | MAPTALDH1A1GAAL3MBTL1CHRM2 | |
| SCHEMBL12881488 | 0.79 | ACHE (0.43) | MAPTGAATDP1L3MBTL1CHRM2 | |
| SCHEMBL13601724 | 0.78 | MAPT (0.44) | MAPTALDH1A1HTR1AGAACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |