Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11814039 | 0.87 | ADORA2A (0.37) | ADORA2AADORA2BADORA1 | |
| SCHEMBL11807421 | 0.80 | DPP4 (0.39) | ADORA2AADORA1ADRB2ADRB1 | |
| SCHEMBL11817465 | 0.77 | ADORA2A (0.40) | ADORA2AADORA2BADORA1 | |
| SCHEMBL11811344 | 0.77 | DHFR (0.30) | — | |
| SCHEMBL11812057 | 0.72 | DPP4 (0.41) | ADORA2AADORA2BADORA1ADRB2ADRB1 | |
| SCHEMBL11804027 | 0.70 | DHFR (0.32) | — | |
| SCHEMBL11819659 | 0.70 | — | — | |
| SCHEMBL11810331 | 0.70 | S1PR1 (0.34) | — | |
| SCHEMBL11812366 | 0.69 | ADRB2 (0.30) | ADRB2ADRB1 | |
| SCHEMBL11811550 | 0.69 | ADRB2 (0.30) | ADRB2ADRB1 |
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-3954438-A | 5-Trifluoromethyl-7-aminobenzimidazoles herbicides | UNITED STATES BORAX & CHEMICAL CORPORATION (US) | 1976-05-04 | — | — | US | disclosed |