Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMARCA2 | P51531 | 1/20 | 0.44 |
| ▸ | PTAFR | P25105 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690514 | 0.77 | SIGMAR1 (0.47) | ALDH1A1HTTNPSR1MEN1KMT2A | |
| SCHEMBL10691167 | 0.71 | SMARCA2 (0.49) | SMARCA2PTAFRNR1I2ADORA3HTR2C | |
| SCHEMBL28668332 | 0.66 | SMN1; SMN2 (0.52) | ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL9926031 | 0.63 | ALDH1A1 (0.52) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL3695975 | 0.61 | CES2 (0.60) | PTGS2HTTATMMEN1KMT2A | |
| SCHEMBL2090869 | 0.61 | AKR1C3 (0.47) | NOTUMALDH1A1HTTGRM5LMNA | |
| SCHEMBL10083645 | 0.60 | SMN1; SMN2 (0.61) | ALDH1A1MITFHSP90AA1HTTATM | |
| SCHEMBL7763955 | 0.60 | PARP1 (0.50) | HTTMEN1KMT2ATSHR | |
| SCHEMBL10690156 | 0.60 | KCNH2 (0.42) | ALDH1A1HTTNPSR1MEN1KMT2A | |
| SCHEMBL5923918 | 0.60 | ALDH1A1 (0.58) | NOTUMALDH1A1DRD2DRD4 |
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-4732989-A | INTERMEDIATES FOR BACTERICIDES | G. D. SEARLE & CO. (US) | 1988-03-22 | — | — | US | disclosed |
| US-4661602-A | ANTIANAEROBIC AGENTS | G. D. SEARLE & CO. (US) | 1987-04-28 | — | — | US | disclosed |