Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 5/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 2/20 | 0.33 |
| ▸ | CHUK | O15111 | 1/20 | 0.33 |
| ▸ | CSF1R | P07333 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25253204 | 0.78 | SLC6A4 (0.57) | GPR84CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL30877205 | 0.75 | KDM4E (0.52) | GPR84SLC6A4HTR1AHTR1BAPP | |
| SCHEMBL30877313 | 0.73 | KDM4E (0.44) | GPR84SLC6A4HTR2AAPP | |
| SCHEMBL31295173 | 0.70 | HTR2A (0.59) | GPR84CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL21624123 | 0.70 | SLC6A4 (0.42) | GPR84SLC6A4HTR2AHTR1ADRD1 | |
| SCHEMBL25247025 | 0.70 | CHRNB2 (0.42) | CHRNB2CHRNA4CHRNB4CHRNA3SLC6A4 | |
| SCHEMBL25245546 | 0.68 | HTR2C (0.36) | CHRNB2CHRNA4SLC6A4HTR2AIKBKB | |
| SCHEMBL25293329 | 0.68 | CHRNB2 (0.36) | CHRNB2CHRNA4SLC6A4SLC6A2SLC6A3 | |
| SCHEMBL25245272 | 0.68 | CHRNB2 (0.40) | CHRNB2CHRNA4SLC6A4HTR2AIKBKB | |
| SCHEMBL22688651 | 0.67 | GPR84 (0.58) | GPR84SLC6A4ARALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4447954-A1 | HETEROCYCLIC COMPOUNDS AS 5HT2A BIASED AGONISTS | Icahn School of Medicine at Mount Sinai (US) | 2024-10-23 | — | — | EP | disclosed |
| WO-2023114472-A1 | HETEROCYCLIC COMPOUNDS AS 5HT2A BIASED AGONISTS | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2023-06-22 | — | — | WO | disclosed |
| WO-2023114472-A1 | HETEROCYCLIC COMPOUNDS AS 5HT2A BIASED AGONISTS | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2023-06-22 | — | — | WO | disclosed |