Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.43 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9264420 | 0.90 | CXCR3 (0.39) | ADORA3PTGER1ADORA1DHODHKDM4E | |
| SCHEMBL9257773 | 0.89 | ADORA2B (0.37) | PTGER1ADORA2BADORA1FAAHNR4A2 | |
| SCHEMBL9261214 | 0.89 | ADORA2B (0.41) | PDE4DADORA2BADORA1KDM4EALDH1A1 | |
| SCHEMBL9258312 | 0.88 | ADORA1 (0.38) | ADORA3ADORA2BADORA1KDM4EALDH1A1 | |
| SCHEMBL9263544 | 0.84 | HPGD (0.40) | PDE4DADORA2BADORA1KDM4EALDH1A1 | |
| SCHEMBL9264676 | 0.78 | GABRA1 (0.46) | ADORA3PTGER1FAAHNR4A2KDM4E | |
| SCHEMBL9416617 | 0.77 | ADORA1 (0.39) | ADORA3ADORA2BADORA1KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL9260218 | 0.76 | ADORA1 (0.38) | ADORA3ADORA2BADORA1KDM4EALDH1A1 | |
| SCHEMBL9258551 | 0.75 | TRPM2 (0.37) | FAAHKDM4EALDH1A1 | |
| SCHEMBL9261565 | 0.75 | LMNA (0.48) | ADORA3PTGER1NR1I2EGFRADRA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5466706-A | Compounds for hypnotics, anxiety or anticonvulsants | SYNTHELABO (FR) | 1995-11-14 | — | — | US | disclosed |
| EP-0607076-A1 | 9H-Imidazo 1,2-a benzimidazole derivatives with GABA activity | SYNTHELABO (FR) | 1994-07-20 | — | — | EP | disclosed |