Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RORB | Q92753 | 2/20 | 0.36 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.35 |
| ▸ | TUBB | P07437 | 1/20 | 0.35 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.35 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.35 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.35 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.35 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.35 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.35 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4259652 | 0.89 | NR4A2 (0.34) | ABCG2GSK3BALDH1A1GAAMAPT | |
| SCHEMBL4257168 | 0.89 | POLB (0.33) | ABCG2ALDH1A1MAPTKMT2ANPSR1 | |
| SCHEMBL3979300 | 0.85 | CDK2 (0.36) | ALDH1A1MAPTRORCMEN1KMT2A | |
| SCHEMBL3988367 | 0.84 | RORC (0.40) | ALDH1A1RORCMEN1KMT2ACNR2 | |
| SCHEMBL3993826 | 0.82 | RORC (0.42) | ABCG2ALDH1A1GAAMAPTRORB | |
| SCHEMBL3972624 | 0.79 | POLB (0.55) | ALDH1A1MAPTMEN1KMT2ARAB9A | |
| SCHEMBL3986985 | 0.76 | ABCG2 (0.47) | ABCG2GSK3BALDH1A1GAAHPGD | |
| SCHEMBL3995936 | 0.76 | ALDH1A1 (0.44) | ABCG2ALDH1A1RAB9ACNR2 | |
| SCHEMBL4257184 | 0.74 | PCSK9 (0.36) | ALDH1A1MAPTRORCMEN1HPGD | |
| SCHEMBL17908066 | 0.74 | ABCG2 (0.50) | ABCG2GSK3BALDH1A1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2065382-A1 | CGRP antagonists | Boehringer Ingelheim Pharma GmbH & Co. KG (DE) | 2009-06-03 | — | — | EP | disclosed |