Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19953762 | 0.86 | ALDH1A1 (0.46) | HDAC4HDAC7HDAC5BRD4TSHR | |
| SCHEMBL19960585 | 0.82 | HDAC4 (0.48) | HDAC4HDAC7HDAC5BRD4TSHR | |
| SCHEMBL31469975 | 0.78 | OPRM1 (0.50) | HDAC4HDAC7HDAC5BRD4TSHR | |
| SCHEMBL6746146 | 0.78 | OPRM1 (0.50) | HDAC4HDAC7HDAC5BRD4TSHR | |
| SCHEMBL19953584 | 0.76 | FABP5 (0.43) | HDAC4HDAC7HDAC5KMT2ASMN1; SMN2 | |
| SCHEMBL19953533 | 0.76 | FABP5 (0.43) | HDAC4HDAC7HDAC5KMT2ASMN1; SMN2 | |
| SCHEMBL19953489 | 0.76 | FABP5 (0.43) | HDAC4HDAC7HDAC5KMT2ASMN1; SMN2 | |
| SCHEMBL19960839 | 0.75 | HDAC4 (0.39) | HDAC4HDAC7HDAC5BRD4KMT2A | |
| SCHEMBL19953763 | 0.74 | HDAC4 (0.42) | HDAC4HDAC7HDAC5BRD4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL19953504 | 0.74 | HDAC4 (0.38) | HDAC4HDAC7HDAC5BRD4KMT2A |
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-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |