Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 4/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20883957 | 0.77 | TSHR (0.35) | ALDH1A1KDM4EESR1ESR2KMT2A | |
| SCHEMBL20884969 | 0.77 | TBK1 (0.34) | ALDH1A1MAPTLMNAKDM4ETP53 | |
| SCHEMBL4399692 | 0.76 | CHRNB2 (0.45) | CHRNA7HTR3AALDH1A1MAPTKDM4E | |
| SCHEMBL20439174 | 0.75 | HIF1A (0.44) | ALDH1A1LMNAESR1ESR2GAA | |
| SCHEMBL23474002 | 0.73 | MAPT (0.42) | CHRNA7HTR3AALDH1A1MAPTLMNA | |
| SCHEMBL8233882 | 0.73 | F9 (0.47) | CHRNA7HTR3AALDH1A1MAPTLMNA | |
| SCHEMBL25591522 | 0.73 | CHRNA7 (0.40) | CHRNA7HTR3AALDH1A1MAPTLMNA | |
| SCHEMBL1101176 | 0.73 | ESR1 (0.45) | CHRNA7HTR3AMAPTESR1ESR2 | |
| SCHEMBL16048336 | 0.72 | CSF1R (0.39) | — | |
| SCHEMBL23175518 | 0.71 | HTR2A (0.51) | CHRNA7HTR3AHTR2ADRD3CYP1A2 |
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-2019074979-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | GIRAFPHARMA, LLC (US) | 2019-04-18 | — | — | WO | disclosed |