Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | RXRA | P19793 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL9735873 | 1.00 | DPP4 (0.41) | DPP4RXRAHTTNCOA3PDE4D | |
| SCHEMBL9384462 | 0.85 | RXRA (0.40) | RXRAHTTPDE4DNR1I2NR4A2 | |
| SCHEMBL9736090 | 0.85 | RXRA (0.40) | RXRAHTTPDE4DNR1I2NR4A2 | |
| SCHEMBL9387195 | 0.84 | DPP4 (0.42) | DPP4HTTNCOA3HMGCRMAPK14 | |
| SCHEMBL9734648 | 0.84 | DPP4 (0.42) | DPP4HTTNCOA3HMGCRMAPK14 | |
| SCHEMBL9384186 | 0.69 | GCGR (0.38) | HMGCRKDM4EALDH1A1 | |
| SCHEMBL9735137 | 0.69 | GCGR (0.38) | HMGCRKDM4EALDH1A1 | |
| SCHEMBL29466456 | 0.69 | RXRA (0.75) | RXRAPDE4DNR1I2NR4A2HMGCR | |
| SCHEMBL1844436 | 0.69 | RXRA (0.75) | RXRAPDE4DNR1I2NR4A2HMGCR | |
| SCHEMBL1843198 | 0.69 | RXRA (0.75) | RXRAPDE4DNR1I2NR4A2HMGCR |
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-5145959-A | Enzyme inhibitors; antilipemic agents; treatment of atherosclerosis | BAYER AKTIENGESELLSCHAFT (DE) | 1992-09-08 | — | — | US | claimed |