Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 2/20 | 0.40 |
| ▸ | IP6K3 | Q96PC2 | 2/20 | 0.40 |
| ▸ | IP6K2 | Q9UHH9 | 2/20 | 0.40 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | LIPE | Q05469 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13183806 | 0.79 | P2RX3 (0.47) | P2RX3SMN1; SMN2LMNACYP2C9TSHR | |
| SCHEMBL31459066 | 0.70 | TPMT (0.49) | P2RX3TSHR | |
| SCHEMBL1425009 | 0.70 | TPMT (0.49) | P2RX3TSHR | |
| SCHEMBL2527243 | 0.68 | PDE4B (0.64) | — | |
| SCHEMBL21191142 | 0.68 | TDP1 (0.49) | P2RX3SMN1; SMN2LMNACYP2C9TSHR | |
| SCHEMBL28366537 | 0.68 | PTGER4 (0.56) | SMN1; SMN2LMNACYP2C9TSHRAPEX1 | |
| SCHEMBL31132793 | 0.68 | HCAR2 (0.41) | SMN1; SMN2CYP2C9TSHRMAPK1 | |
| SCHEMBL17069361 | 0.68 | MAPT (0.50) | SMN1; SMN2LMNACYP2C9 | |
| SCHEMBL19622290 | 0.68 | PDE4B (0.41) | — | |
| SCHEMBL2365611 | 0.67 | PPARG (0.63) | SMN1; SMN2LMNACYP2C9TSHRAPEX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3246034-A1 | BORON-CONTAINING SMALL MOLECULES AS ANTI-INFLAMMATORY AGENTS | Anacor Pharmaceuticals, Inc. (US) | 2017-11-22 | — | — | EP | disclosed |