Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL13601635 | 0.93 | LMNA (0.55) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL12881500 | 0.88 | LMNA (0.50) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL13601424 | 0.87 | HRH3 (0.53) | HRH3LMNAPOLBALDH1A1KMT2A | |
| SCHEMBL13601672 | 0.86 | TSHR (0.56) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL12881508 | 0.85 | LMNA (0.47) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL12881528 | 0.83 | LMNA (0.47) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL12881504 | 0.81 | LMNA (0.52) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL13601627 | 0.80 | NPC1 (0.58) | LMNAPOLBTSHRALDH1A1NPC1 | |
| SCHEMBL17285955 | 0.79 | NPC1 (0.60) | HRH3LMNAPOLBTSHRALDH1A1 | |
| SCHEMBL2606050 | 0.78 | NPC1 (0.67) | LMNAPOLBTSHRALDH1A1NPC1 |
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 |