Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.39 |
| ▸ | CALCRL | Q16602 | 7/20 | 0.37 |
| ▸ | RAMP1 | O60894 | 2/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.36 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | ADM2 | Q7Z4H4 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PLK4 | O00444 | 1/20 | 0.35 |
| ▸ | CALCB | P10092 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31084963 | 1.00 | IP6K1 (0.39) | IP6K1CALCRLRAMP1CRBNMAP3K11 | |
| SCHEMBL22796621 | 1.00 | IP6K1 (0.39) | IP6K1CALCRLRAMP1CRBNMAP3K11 | |
| SCHEMBL29517785 | 1.00 | IP6K1 (0.39) | IP6K1CALCRLRAMP1CRBNMAP3K11 | |
| SCHEMBL29996255 | 1.00 | IP6K1 (0.39) | IP6K1CALCRLRAMP1CRBNMAP3K11 | |
| SCHEMBL29733100 | 1.00 | IP6K1 (0.39) | IP6K1CALCRLRAMP1CRBNMAP3K11 | |
| SCHEMBL22796344 | 0.87 | CALCRL (0.42) | CALCRLRAMP1 | |
| SCHEMBL31126018 | 0.87 | CALCRL (0.42) | CALCRLRAMP1 | |
| SCHEMBL28721100 | 0.87 | CALCRL (0.42) | CALCRLRAMP1 | |
| SCHEMBL29518096 | 0.87 | CALCRL (0.42) | CALCRLRAMP1 | |
| SCHEMBL7033786 | 0.86 | CALCRL (0.38) | IP6K1CALCRLRAMP1ADM2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020249970-A1 | CGRP ANTAGONIST COMPOUNDS | HEPTARES THERAPEUTICS LIMITED (GB) | 2020-12-17 | — | — | WO | disclosed |