Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.37 |
| ▸ | HPGD | P15428 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | KHK | P50053 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20093625 | 0.89 | CYP11B1 (0.43) | CYP11B1CYP11B2KDM4ELMNAALDH1A1 | |
| SCHEMBL20093956 | 0.81 | CYP11B2 (0.47) | CYP11B1CYP11B2LMNAALDH1A1HTT | |
| SCHEMBL18822948 | 0.79 | CYP11B1 (0.48) | CYP11B1CYP11B2KDM4EALDH1A1HPGD | |
| SCHEMBL17320658 | 0.77 | CYP11B1 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL1859517 | 0.76 | HTT (0.34) | CYP11B1CYP11B2LMNAALDH1A1HPGD | |
| SCHEMBL15970969 | 0.75 | CYP11B2 (0.46) | CYP11B1CYP11B2MEN1KMT2A | |
| SCHEMBL13262184 | 0.72 | HPGD (0.34) | CYP11B1CYP11B2LMNAALDH1A1HPGD | |
| SCHEMBL1779534 | 0.68 | CYP11B1 (0.41) | CYP11B1CYP11B2KDM4EALDH1A1TP53 | |
| SCHEMBL1857043 | 0.68 | POLB (0.32) | KDM4EGLAPOLBGAA | |
| SCHEMBL24411352 | 0.68 | CYP11B1 (0.40) | CYP11B1CYP11B2LMNAMAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019025398-A1 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2019-02-07 | — | — | WO | disclosed |
| WO-2018073159-A2 | LIQUID-CRYSTAL MEDIUM | MERCK PATENT GMBH (DE) | 2018-04-26 | — | — | WO | disclosed |