Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | RAMP1 | O60894 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29518078 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL22796538 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL29558966 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL1812906 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL29560101 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL29416301 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL31084946 | 1.00 | CALCRL (0.38) | CALCRLALOX15HTTNPC1ALDH1A1 | |
| SCHEMBL1812252 | 0.91 | CALCRL (0.38) | CALCRLNPC1BACE1RAMP1 | |
| SCHEMBL28717222 | 0.91 | CALCRL (0.38) | CALCRLNPC1BACE1RAMP1 | |
| SCHEMBL16912987 | 0.90 | CALCRL (0.35) | CALCRLNPC1RAMP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020249970-A1 | CGRP ANTAGONIST COMPOUNDS | HEPTARES THERAPEUTICS LIMITED (GB) | 2020-12-17 | — | — | WO | disclosed |
| WO-2020249969-A1 | CGRP ANTAGONIST COMPOUNDS | HEPTARES THERAPEUTICS LIMITED (GB) | 2020-12-17 | — | — | WO | disclosed |