Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | GNAI3 | P08754 | 5/20 | 0.50 |
| ▸ | GNAI1 | P63096 | 5/20 | 0.50 |
| ▸ | GNAO1 | P09471 | 4/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.49 |
| ▸ | DGKA | P23743 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13601659 | 0.94 | LMNA (0.49) | HTR2CGNAI3GNAI1GNAO1DGKA | |
| SCHEMBL12881491 | 0.88 | GNAI3 (0.69) | HTR2CGNAI3GNAI1GNAO1NAAA | |
| SCHEMBL13601654 | 0.88 | TSHR (0.51) | GNAI3GNAI1GNAO1LMNAPOLB | |
| SCHEMBL12881511 | 0.87 | GNAI3 (0.51) | HTR2CGNAI3GNAI1GNAO1NAAA | |
| SCHEMBL12881522 | 0.87 | GNAI3 (0.51) | HTR2CGNAI3GNAI1GNAO1NAAA | |
| SCHEMBL17558020 | 0.84 | HRH2 (0.50) | HTR2CNAAADGKATHRATHRB | |
| SCHEMBL17557993 | 0.84 | HRH2 (0.50) | HTR2CNAAADGKATHRATHRB | |
| SCHEMBL17576888 | 0.84 | HRH2 (0.50) | HTR2CNAAADGKATHRATHRB | |
| SCHEMBL17557980 | 0.84 | HRH2 (0.50) | HTR2CNAAADGKATHRATHRB | |
| SCHEMBL17557975 | 0.84 | HRH2 (0.50) | HTR2CNAAADGKATHRATHRB |
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 |