Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | ELANE | P08246 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9836701 | 0.87 | KMT2A (0.49) | NPSR1KDM4EGAACYP3A4ELANE | |
| SCHEMBL9120147 | 0.83 | NPSR1 (0.69) | NPSR1HPGDSMN1; SMN2KDM4EGAA | |
| SCHEMBL11818486 | 0.80 | SMN1; SMN2 (0.53) | NPSR1HPGDSMN1; SMN2KDM4EGAA | |
| SCHEMBL21116053 | 0.79 | HTT (0.71) | NPSR1HPGDSMN1; SMN2KDM4EGAA | |
| SCHEMBL7492934 | 0.78 | HSP90AA1 (0.56) | NPSR1HPGDSMN1; SMN2KDM4EGAA | |
| SCHEMBL9120841 | 0.77 | KDM4E (0.51) | NPSR1HPGDSMN1; SMN2KDM4EGAA | |
| SCHEMBL9118463 | 0.75 | HSP90AA1 (0.55) | NPSR1HPGDKDM4EGAAHTT | |
| SCHEMBL11820276 | 0.74 | KDM4E (0.70) | HPGDSMN1; SMN2KDM4EGAACYP3A4 | |
| SCHEMBL9836195 | 0.74 | LMNA (0.53) | NPSR1HPGDKDM4EGAATSHR | |
| SCHEMBL7431402 | 0.73 | HSP90AA1 (0.42) | NPSR1HPGDSMN1; SMN2KDM4EGAA |
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-4721708-A | CYCLICATION WITH LEWIS ACIDS | MERCK & CO., INC. (US) | 1988-01-26 | — | — | US | disclosed |