Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.33 |
| ▸ | ALB | P02768 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL28258623 | 0.91 | GABRA1 (0.39) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL28260120 | 0.89 | GABRA1 (0.40) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL9734683 | 0.89 | PTGS2 (0.36) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL14606816 | 0.84 | PTGS2 (0.36) | GABRA1GABRB2PTGS2PTGS1LMNA | |
| SCHEMBL10526433 | 0.82 | PTGS2 (0.32) | GABRA1GABRB2PTGS2AKR1C3TSHR | |
| SCHEMBL5164582 | 0.78 | GABRA1 (0.42) | GABRA1GABRB2PTGS2ESR1OPRM1 | |
| SCHEMBL21779670 | 0.78 | GABRA1 (0.34) | GABRA1GABRB2PTGS2PTGS1EPHX1 | |
| SCHEMBL22861018 | 0.78 | PNMT (0.38) | GABRA1GABRB2AKR1C2OPRM1FAAH | |
| SCHEMBL15249714 | 0.78 | PLG (0.33) | PTGS2LMNACYP1A2CYP2A6 | |
| SCHEMBL24446732 | 0.78 | NOS3 (0.37) | GABRA1GABRB2PTGS2PTGS1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4122945-A1 | METHODS AND COMPOSITIONS FOR RIBOSOMAL SYNTHESIS OF MACROCYCLIC PEPTIDES | University of Rochester (US) | 2023-01-25 | — | — | EP | disclosed |