Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC1 | P33527 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9810353 | 0.91 | ABCC1 (0.40) | ABCC1NPSR1SMN1; SMN2HPGDCACNA1D | |
| SCHEMBL9810505 | 0.89 | POLB (0.42) | ABCC1NPSR1SMN1; SMN2HPGDCACNA1D | |
| SCHEMBL9810251 | 0.88 | TSHR (0.41) | ABCC1NPSR1SMN1; SMN2HPGDLMNA | |
| SCHEMBL9810551 | 0.87 | ALDH1A1 (0.42) | ABCC1LMNAALDH1A1MAPTTSHR | |
| SCHEMBL9810432 | 0.87 | ALDH1A1 (0.42) | ABCC1LMNAALDH1A1MAPTTSHR | |
| SCHEMBL9810308 | 0.86 | SLC6A3 (0.45) | NPSR1HPGDLMNAALDH1A1GAA | |
| SCHEMBL9810329 | 0.85 | ALDH1A1 (0.50) | NPSR1SMN1; SMN2HPGDCACNA1DLMNA | |
| SCHEMBL9810315 | 0.85 | CCR1 (0.37) | ABCC1NPSR1SMN1; SMN2HPGDCACNA1D | |
| SCHEMBL9810372 | 0.83 | SRD5A1 (0.39) | ABCC1NPSR1SMN1; SMN2HPGDMEN1 | |
| SCHEMBL9810407 | 0.82 | CYP2C9 (0.52) | SMN1; SMN2HPGDLMNAALDH1A1ESR2 |
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-5068389-A | TERTIARY ALCOHOLS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |