Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 9/20 | 0.60 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.60 |
| ▸ | TLR4 | O00206 | 7/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 8/20 | 0.58 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.58 |
| ▸ | DRD2 | P14416 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.53 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.53 |
| ▸ | MLNR | O43193 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | APP | P05067 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17946159 | 0.85 | ADRB3 (0.67) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL2994535 | 0.80 | ADRB2 (0.68) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL4052917 | 0.80 | ADRB2 (0.67) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL13206996 | 0.80 | ADRB2 (0.71) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL4051858 | 0.80 | ADRB2 (0.67) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL5694608 | 0.80 | ADRB2 (0.67) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL13206928 | 0.80 | ADRB2 (0.71) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL6074582 | 0.80 | ADRB2 (0.67) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL13206999 | 0.80 | ADRB2 (0.71) | ADRB2DNM1TLR4ADRB3ADRB1 | |
| SCHEMBL2993363 | 0.78 | TLR4 (0.69) | ADRB2DNM1TLR4ADRB3ADRB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106316929-A | Method of preparing important intermediate 1-(9H-4-carbazoleoxy)-5-phenyl-2-pentanol of carvedilol | 江苏苏南药业实业有限公司 | 2017-01-11 | — | — | CN | disclosed |