Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | THRA | P10827 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13601725 | 0.93 | TSHR (0.49) | SMN1; SMN2LMNAPOLBGAAALDH1A1 | |
| SCHEMBL13601724 | 0.89 | MAPT (0.44) | GAAALDH1A1NPC1KDM4EMAPT | |
| SCHEMBL28060009 | 0.84 | ALDH1A1 (0.53) | SMN1; SMN2LMNAPOLBALDH1A1NPC1 | |
| SCHEMBL5594524 | 0.82 | POLB (0.65) | SMN1; SMN2LMNAPOLBGAAALDH1A1 | |
| SCHEMBL13601729 | 0.82 | MAPT (0.39) | GAAALDH1A1NPC1MAPTHTR1A | |
| SCHEMBL13601717 | 0.82 | MAPT (0.59) | SMN1; SMN2POLBGAAALDH1A1KDM4E | |
| SCHEMBL5875276 | 0.81 | SMN1; SMN2 (0.44) | SMN1; SMN2LMNAPOLBGAAALDH1A1 | |
| SCHEMBL12881455 | 0.81 | GNAI3 (0.58) | SMN1; SMN2GAAMAPTTHRATHRB | |
| SCHEMBL12881468 | 0.80 | GNAI3 (0.42) | SMN1; SMN2GAAMAPTTHRATHRB | |
| SCHEMBL12881482 | 0.80 | GNAI3 (0.42) | SMN1; SMN2GAAMAPTTHRATHRB |
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 |