Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 5/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9383069 | 1.00 | GCGR (0.39) | GCGRCYP1A2CYP2C19TYMPIDO1 | |
| SCHEMBL9382441 | 0.89 | GCGR (0.42) | GCGRCYP1A2CYP2C19TYMPIDO1 | |
| SCHEMBL9736123 | 0.81 | GCGR (0.37) | GCGRCYP1A2CYP2C19IDO1ALDH1A1 | |
| SCHEMBL9736133 | 0.81 | GCGR (0.37) | GCGRCYP1A2CYP2C19IDO1ALDH1A1 | |
| SCHEMBL8949683 | 0.80 | GCGR (0.53) | GCGRHMGCRESR1CHRM1TBXA2R | |
| SCHEMBL9523672 | 0.80 | GCGR (0.40) | GCGRCYP1A2CYP2C19HMGCRESR1 | |
| SCHEMBL9791356 | 0.80 | GCGR (0.40) | GCGRCYP1A2CYP2C19HMGCRESR1 | |
| SCHEMBL9735142 | 0.79 | HMGCR (0.49) | GCGRALDH1A1HMGCRESR1CHRM1 | |
| SCHEMBL9735125 | 0.79 | HMGCR (0.49) | GCGRALDH1A1HMGCRESR1CHRM1 | |
| SCHEMBL9384186 | 0.78 | GCGR (0.38) | GCGRALDH1A1HMGCRESR1CHRM1 |
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-5145959-A | Enzyme inhibitors; antilipemic agents; treatment of atherosclerosis | BAYER AKTIENGESELLSCHAFT (DE) | 1992-09-08 | — | — | US | disclosed |
| US-5075311-A | Anticholesterol agents | BAYER AKTIENGESELLSCHAFT (DE) | 1991-12-24 | — | — | US | disclosed |