Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 5/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | RCOR1 | Q9UKL0 | 2/20 | 0.32 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ESRRG | P62508 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177592 | 0.76 | ESRRG (0.34) | ESR2BRD4TSHRESRRG | |
| SCHEMBL20177606 | 0.73 | TSHR (0.57) | BRD4TSHRPKMGAA | |
| SCHEMBL481990 | 0.73 | TSHR (0.57) | BRD4TSHRPKMGAA | |
| SCHEMBL11080147 | 0.69 | GABRP (0.39) | BRD4KDM1AKCNH2MAOBRCOR1 | |
| SCHEMBL12540718 | 0.67 | ESR2 (0.56) | ESR2BRD4KDM1AKCNH2MAOB | |
| SCHEMBL12540716 | 0.67 | ESR2 (0.56) | ESR2BRD4KDM1AKCNH2MAOB | |
| SCHEMBL12540720 | 0.67 | ESR2 (0.56) | ESR2BRD4KDM1AKCNH2MAOB | |
| SCHEMBL15301182 | 0.66 | ESRRG (0.48) | BRD4KDM1AKCNH2MAOBRCOR1 | |
| SCHEMBL12814549 | 0.66 | MAP1LC3B (0.44) | BRD4MAPTSMN1; SMN2LMNAMAP1LC3B | |
| SCHEMBL12382040 | 0.66 | BRD4 (0.33) | BRD4KDM1AKCNH2MAOBRCOR1 |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |