Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.57 |
| ▸ | MAOB | P27338 | 10/20 | 0.56 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.54 |
| ▸ | MAOA | P21397 | 6/20 | 0.54 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.48 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8419871 | 1.00 | AHR (0.57) | AHRMAOBCHRNA7MAOAESR1 | |
| SCHEMBL1172115 | 0.84 | NFE2L2 (0.50) | MAOBCHRNA7MAOA | |
| SCHEMBL1172116 | 0.84 | NFE2L2 (0.50) | MAOBCHRNA7MAOA | |
| SCHEMBL27912685 | 0.83 | PPARG (0.55) | AHRMAOBCHRNA7ESR1CYP1A1 | |
| SCHEMBL1171656 | 0.81 | LTB4R (0.56) | AHRMAOBCHRNA7MAOACHRNA10 | |
| SCHEMBL1171655 | 0.81 | LTB4R (0.56) | AHRMAOBCHRNA7MAOACHRNA10 | |
| SCHEMBL6179433 | 0.78 | RELA (0.49) | CHRNA7CHRNA10CHRNA9 | |
| SCHEMBL6179434 | 0.78 | RELA (0.49) | CHRNA7CHRNA10CHRNA9 | |
| SCHEMBL31040563 | 0.78 | TDP1 (0.54) | AHRMAOBCHRNA7MAOA | |
| SCHEMBL31040562 | 0.78 | TDP1 (0.54) | AHRMAOBCHRNA7MAOA |
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-5872148-A | BRONCHODILATOR AGENTS AND ANALGESICS | UNIVERSITY OF CONNECTICUT (US) | 1999-02-16 | — | — | US | disclosed |
| US-5440052-A | Compositions useful as a cannabinoid receptor probe | UNIVERSITY OF CONNECTICUT (US) | 1995-08-08 | — | — | US | disclosed |