Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | CEPT1 | Q9Y6K0 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 9/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CETP | P11597 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL2223599 | 0.93 | S1PR1 (0.47) | S1PR1CEPT1TP53THRBAPP | |
| SCHEMBL2223206 | 0.91 | S1PR1 (0.47) | S1PR1CEPT1APPMAOBUSP2 | |
| SCHEMBL2222292 | 0.91 | S1PR1 (0.44) | S1PR1 | |
| SCHEMBL2224142 | 0.89 | S1PR1 (0.51) | S1PR1TP53APPCETPRXFP1 | |
| SCHEMBL2224913 | 0.89 | S1PR1 (0.47) | S1PR1CEPT1APPCETPALDH1A1 | |
| SCHEMBL2222186 | 0.88 | S1PR1 (0.48) | S1PR1CEPT1TP53THRBAPP | |
| SCHEMBL2224919 | 0.88 | S1PR1 (0.49) | S1PR1CEPT1TP53THRBCETP | |
| SCHEMBL2224286 | 0.87 | S1PR1 (0.54) | S1PR1CEPT1TP53THRBAPP | |
| SCHEMBL2225559 | 0.86 | S1PR1 (0.49) | S1PR1CEPT1TP53THRBAPP | |
| SCHEMBL14797212 | 0.85 | S1PR1 (0.66) | S1PR1CEPT1TP53THRBCETP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011086079-A1 | CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING | SANOFI-AVENTIS (FR) | 2011-07-21 | — | — | WO | disclosed |