Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | NCF1 | P14598 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 2/20 | 0.39 |
| ▸ | TACR3 | P29371 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL25523537 | 0.83 | ACHE (0.60) | ACHENCF1DHODHTSHRTACR3 | |
| SCHEMBL25522194 | 0.79 | AR (0.50) | CYP1A2LMNASMN1; SMN2KDM4EHPGD | |
| SCHEMBL25524104 | 0.75 | PDGFRB (0.51) | CYP1A2LMNASMN1; SMN2KDM4EHPGD | |
| SCHEMBL25522058 | 0.74 | ADORA2A (0.50) | ADORA2ALMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL2873300 | 0.74 | ACHE (1.00) | ACHENCF1DHODHACACAADORA2A | |
| SCHEMBL25522191 | 0.74 | NPC1 (0.50) | CYP1A2KDM4ENPC1RAB9A | |
| SCHEMBL4155489 | 0.73 | ACHE (0.72) | ACHENCF1DHODHACACACYP1A2 | |
| SCHEMBL25524007 | 0.72 | PDGFRB (0.40) | SMN1; SMN2KDM4EHPGDALDH1A1 | |
| SCHEMBL25189022 | 0.72 | RAB9A (0.49) | ACHENCF1CYP1A2LMNASMN1; SMN2 | |
| SCHEMBL28516025 | 0.71 | ACHE (0.93) | ACHENCF1DHODHACACAADORA2A |
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-2023086428-A2 | NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF | ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) | 2023-05-19 | — | — | WO | disclosed |