Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | HMGCR | P04035 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CPT2 | P23786 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.32 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL27545156 | 0.82 | MMP8 (0.40) | CYP2D6ALDH1A1 | |
| SCHEMBL29021007 | 0.81 | KDM4E (0.41) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL8130268 | 0.77 | HMGCR (0.46) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| Hydrogen Peroxide SCHEMBL28864226 | 0.77 | CPT2 (0.50) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL1067575 | 0.77 | CPT2 (0.50) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL28080995 | 0.77 | HMGCR (0.46) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL27968280 | 0.75 | CYP2D6 (0.42) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL537136 | 0.75 | CYP2D6 (0.42) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL28715378 | 0.75 | HMGCR (0.64) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 | |
| SCHEMBL30839238 | 0.73 | ALDH1A1 (0.61) | ADRA1AHMGCRCHRM1TBXA2RCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-4457924-A | PENICILLINS, OXAPENICILLINS, BETA-LACTAMASE INHIBITORS | PFIZER, INC. (US) | 1984-07-03 | — | — | US | disclosed |