Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3079111 | 0.87 | PDCD1 (0.43) | GABRA1GABRB2PDCD1CD274KMT2A | |
| SCHEMBL10601555 | 0.80 | GABRA1 (0.42) | GABRA1GABRB2PDCD1CD274KMT2A | |
| SCHEMBL4630258 | 0.79 | KMT2A (0.60) | GABRA1GABRB2PDCD1CD274KMT2A | |
| SCHEMBL28382984 | 0.78 | PDCD1 (0.41) | PDCD1CD274ADORA3ADORA2AADORA1 | |
| SCHEMBL8679944 | 0.78 | TSHR (0.48) | GABRA1PDCD1CD274DPP4TSHR | |
| SCHEMBL11996557 | 0.77 | GRIA4 (0.43) | PDCD1CD274KMT2ATSHRKCNQ2 | |
| SCHEMBL11996667 | 0.77 | CYP2A6 (0.48) | PDCD1CD274TSHRSLC6A2SLC6A4 | |
| SCHEMBL8679934 | 0.76 | CD274 (0.65) | GABRA1GABRB2PDCD1CD274KMT2A | |
| SCHEMBL2416595 | 0.76 | GABRA1 (0.47) | GABRA1GABRB2PDCD1CD274KMT2A | |
| SCHEMBL28428374 | 0.75 | KMT2A (0.52) | GABRA1GABRB2PDCD1CD274KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0819667-A2 | Processes for production of mono- and/or di- sec. butylbiphenyl and products obtainable therefrom | KOCH INDUSTRIES, INC. (US) | 1998-01-21 | — | — | EP | disclosed |