Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | CMA1 | P23946 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CTSG | P08311 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12164118 | 0.78 | CYP11B2 (0.41) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL473809 | 0.78 | CYP11B2 (0.41) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL13183700 | 0.75 | CYP11B2 (0.46) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL12164117 | 0.72 | CYP11B2 (0.39) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL473990 | 0.72 | CYP11B2 (0.39) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL473836 | 0.72 | GPR55 (0.36) | CYP11B2POLBKMT2ASMN1; SMN2GPR55 | |
| SCHEMBL12164103 | 0.72 | GPR55 (0.36) | CYP11B2POLBKMT2ASMN1; SMN2GPR55 | |
| SCHEMBL12164182 | 0.71 | CYP11B2 (0.39) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL473871 | 0.71 | CYP11B2 (0.39) | CYP11B2CMA1POLBKMT2AALDH1A1 | |
| SCHEMBL13183699 | 0.70 | CYP11B2 (0.44) | CYP11B2CMA1POLBKMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2411365-B1 | 2,3-DIARYL- OR HETEROARYL-SUBSTITUTED 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2014-03-19 | — | — | EP | disclosed |