Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.33 |
| ▸ | CDC25A | P30304 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3166943 | 0.79 | MAPT (0.37) | BRD4CREBBPKDM4EALDH1A1TSHR | |
| SCHEMBL259917 | 0.69 | CALCRL (0.38) | TRPV1HCRTR1HCRTR2 | |
| SCHEMBL12580778 | 0.69 | BRPF1 (0.43) | BRD4BRPF1GAAHCRTR1HCRTR2 | |
| SCHEMBL261495 | 0.63 | HCRTR1 (0.32) | HCRTR1HCRTR2 | |
| SCHEMBL260066 | 0.62 | TRPV1 (0.34) | TRPV1 | |
| SCHEMBL5800676 | 0.61 | GAA (0.49) | BRD4BRPF1CDC25AKDM4EALDH1A1 | |
| SCHEMBL4431229 | 0.61 | GAA (0.49) | BRD4BRPF1CDC25AKDM4EALDH1A1 | |
| SCHEMBL8807424 | 0.60 | OPRM1 (0.38) | — | |
| SCHEMBL260385 | 0.60 | CALCRL (0.55) | HTR1A | |
| SCHEMBL261443 | 0.60 | BRPF1 (0.47) | BRD4BRPF1ALDH1A1SMN1; SMN2 |
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-7947677-B2 | Spirolactam tricyclic CGRP receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2011-05-24 | — | — | US | disclosed |