Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.47 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 5/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8665179 | 1.00 | ACE2 (0.47) | ACE2GABRR1CYP1A2BLMCNR1 | |
| SCHEMBL10037910 | 1.00 | ACE2 (0.47) | ACE2GABRR1CYP1A2BLMCNR1 | |
| SCHEMBL5407252 | 0.91 | GABRR1 (0.54) | ACE2GABRR1CYP1A2BLMCNR1 | |
| SCHEMBL5407249 | 0.91 | GABRR1 (0.54) | ACE2GABRR1CYP1A2BLMCNR1 | |
| SCHEMBL6436922 | 0.88 | ACE2 (0.53) | ACE2CYP1A2BLMCNR1 | |
| SCHEMBL6436924 | 0.88 | ACE2 (0.53) | ACE2CYP1A2BLMCNR1 | |
| SCHEMBL28572541 | 0.88 | ACE2 (0.53) | ACE2CYP1A2BLMCNR1 | |
| SCHEMBL5586095 | 0.87 | GABRR1 (0.46) | ACE2GABRR1CYP1A2BLM | |
| SCHEMBL5586091 | 0.87 | GABRR1 (0.46) | ACE2GABRR1CYP1A2BLM | |
| SCHEMBL5774607 | 0.87 | GABRR1 (0.46) | ACE2GABRR1CYP1A2BLM |
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-5783708-A | HEXAHYDROISOINDOLE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-07-21 | — | — | US | disclosed |
| US-5703094-A | Quinolone- and naphthyridonecarboxylic acid derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |