Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8844392 | 1.00 | HCAR2 (0.36) | HCAR2KEAP1NFE2L2TSHRSMN1; SMN2 | |
| SCHEMBL7765784 | 0.83 | HCAR2 (0.39) | HCAR2KEAP1NFE2L2 | |
| SCHEMBL7765793 | 0.83 | HCAR2 (0.39) | HCAR2KEAP1NFE2L2 | |
| SCHEMBL14814141 | 0.83 | HCAR2 (0.39) | HCAR2KEAP1NFE2L2 | |
| SCHEMBL7772525 | 0.82 | HCAR2 (0.37) | HCAR2KEAP1NFE2L2TSHR | |
| SCHEMBL6877098 | 0.82 | HCAR2 (0.37) | HCAR2KEAP1NFE2L2TSHR | |
| SCHEMBL9910358 | 0.80 | TSHR (0.52) | HCAR2KEAP1NFE2L2TSHR | |
| SCHEMBL27627561 | 0.80 | TSHR (0.52) | HCAR2KEAP1NFE2L2TSHR | |
| SCHEMBL9327902 | 0.78 | CES1 (0.38) | HCAR2KEAP1NFE2L2TSHR | |
| SCHEMBL7772114 | 0.78 | CES1 (0.38) | HCAR2KEAP1NFE2L2TSHR |
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-5627170-A | Phosphonic acid compound containing heterocyclic substituents, pharmaceutical composition contains same and a method of treating calcium metabolism disturbance | BOEHRINGER MANNHEIM GMBH (DE) | 1997-05-06 | — | — | US | disclosed |
| US-5538957-A | OSTEOPOROSIS | BOEHRINGER MANNHEIM GMBH (DE) | 1996-07-23 | — | — | US | disclosed |