Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.48 |
| ▸ | CNR1 | P21554 | 5/20 | 0.46 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | BCR | P11274 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.42 |
| ▸ | TUBB | P07437 | 1/20 | 0.42 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.42 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.42 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10296739 | 0.87 | AHR (0.57) | AHRCYP1A1CYP1B1CNR1CNR2 | |
| SCHEMBL31185805 | 0.82 | AHR (0.58) | AHRCYP1A1CYP1B1ESR1CYP1A2 | |
| SCHEMBL3740076 | 0.81 | FASN (0.45) | ALOX5PTGS2 | |
| SCHEMBL2468062 | 0.81 | FASN (0.45) | ALOX5PTGS2 | |
| SCHEMBL3409009 | 0.81 | FASN (0.45) | ALOX5PTGS2 | |
| SCHEMBL2467060 | 0.79 | ALDH1A1 (0.44) | ALOX5PTGS2 | |
| SCHEMBL904357 | 0.79 | ALDH1A1 (0.44) | ALOX5PTGS2 | |
| SCHEMBL10296724 | 0.78 | AHR (0.48) | AHRCYP1A1CYP1B1CNR1CNR2 | |
| SCHEMBL10296710 | 0.78 | AHR (0.48) | AHRCYP1A1CYP1B1CNR1CNR2 | |
| SCHEMBL23779805 | 0.76 | TLR4 (0.56) | AHRCHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005122670-A2 | BIOMONITORED SYNTHESIS ROUTE FOR LARGE SCALE PREPARATION OF CARDOL (BILOBOL) AND 11Δ-CARDOL | KARDOL INDÚSTRIA QUÍMICA LTDA. (BR) | 2005-12-29 | — | — | WO | disclosed |