Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 11/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 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 | |
|---|---|---|---|---|
| SCHEMBL9092744 | 0.87 | SIGMAR1 (0.53) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL6433983 | 0.84 | CES2 (0.51) | TBXAS1MTNR1AMTNR1B | |
| SCHEMBL4630812 | 0.80 | MTNR1A (0.48) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL1226216 | 0.79 | SIGMAR1 (0.49) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL16684958 | 0.79 | ESR1 (0.46) | — | |
| SCHEMBL7736497 | 0.79 | SIGMAR1 (0.47) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL4535241 | 0.79 | SIGMAR1 (0.47) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL5636415 | 0.79 | SIGMAR1 (0.47) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL11680510 | 0.79 | SIGMAR1 (0.47) | TBXAS1SIGMAR1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL10923405 | 0.78 | TBXAS1 (0.55) | TBXAS1SIGMAR1TBXA2R |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114181039-A | Synthetic method of 4, 4-diphenyl-3-buten-1-ol | 凯美克(上海)医药科技有限公司 | 2022-03-15 | — | — | CN | claimed |
| CN-114181039-A | Synthetic method of 4, 4-diphenyl-3-buten-1-ol | 凯美克(上海)医药科技有限公司 | 2022-03-15 | — | — | CN | disclosed |
| CN-114181039-A | Synthetic method of 4, 4-diphenyl-3-buten-1-ol | 凯美克(上海)医药科技有限公司 | 2022-03-15 | — | — | CN | disclosed |
| CN-114181039-A | Synthetic method of 4, 4-diphenyl-3-buten-1-ol | 凯美克(上海)医药科技有限公司 | 2022-03-15 | — | — | CN | disclosed |
| US-5171800-A | Block copolymerization of vinyl aromatic compounds and conjugated dienes with organoalkalimetal compound; polymerization catalysis | BASF AKTIENGESELLSCHAFT (DE) | 1992-12-15 | — | — | US | disclosed |