Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HRH1 | P35367 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29960369 | 0.99 | ADRA2A (0.40) | ADRA2AADRA1AADRA2BADRA2CADRA1D | |
| SCHEMBL29960550 | 0.85 | PDPK1 (0.36) | ADRA2AADRA1AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL29960604 | 0.84 | HTR2A (0.42) | ADRA2AADRA1AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL29960427 | 0.81 | SRD5A1 (0.38) | ADRA2AADRA1AADRA2BADRA2CADRA1D | |
| SCHEMBL14075302 | 0.75 | NOTUM (0.42) | ADRA2AADRA1AADRA2BADRA2CHTR2A | |
| Hydrochloric Acid SCHEMBL29961290 | 0.75 | KDM4C (0.51) | ADRA2AADRA1AADRA2BADRA2CADRA1D | |
| Hydrochloric Acid SCHEMBL29960255 | 0.72 | KDM4C (0.44) | ADRA2AADRA1AADRA2BADRA2CADRA1D | |
| SCHEMBL14051070 | 0.72 | HTR2A (0.42) | ADRA2AADRA1AADRA2BADRA2CADRA1D | |
| SCHEMBL7834022 | 0.72 | TSHR (0.49) | SLC6A2SLC6A4SRD5A1 | |
| SCHEMBL10468562 | 0.72 | PDPK1 (0.55) | ADRA2AADRA1AADRA2BADRA2CADRA1D |
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-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |