Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | TNKS | O95271 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL27888256 | 0.77 | CYP11B2 (0.65) | CYP11B2HSD11B1ALDH1A1L3MBTL1TNKS | |
| SCHEMBL990213 | 0.76 | — | — | |
| SCHEMBL29848157 | 0.76 | — | — | |
| SCHEMBL7710964 | 0.76 | KDM4E (0.35) | ALDH1A1NAMPTKDM4ETSHRKMT2A | |
| SCHEMBL7712965 | 0.75 | KDM5A (0.37) | — | |
| Formaldehyde SCHEMBL28570916 | 0.75 | CYP11B2 (0.71) | CYP11B2ALDH1A1L3MBTL1TNKSCHRNB2 | |
| SCHEMBL7704805 | 0.75 | HCRTR2 (0.38) | ALDH1A1L3MBTL1KDM4EMEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL28985148 | 0.75 | CYP11B2 (0.77) | CYP11B2ALDH1A1CHRNB2CHRNA4MEN1 | |
| SCHEMBL2546843 | 0.74 | CYP11B2 (0.53) | CYP11B2HSD11B1ALDH1A1L3MBTL1DPP4 | |
| SCHEMBL2546841 | 0.74 | CYP11B2 (0.53) | CYP11B2HSD11B1ALDH1A1L3MBTL1DPP4 |
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-2011131596-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-27 | — | — | WO | disclosed |