Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17883783 | 0.89 | CYP11B2 (0.43) | KDM4EHTTCNR1CNR2SMN1; SMN2 | |
| SCHEMBL17896755 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2DYRK1ALMNAALDH1A1POLB | |
| SCHEMBL10175468 | 0.85 | MET (0.46) | KDM4EHTTCNR1CNR2SMN1; SMN2 | |
| SCHEMBL10175616 | 0.81 | CYP11B1 (0.43) | KDM4EHTTCNR1CNR2SMN1; SMN2 | |
| SCHEMBL459504 | 0.76 | CYP11B2 (0.56) | KDM4EHTTHDAC1HDAC8JAK2 | |
| SCHEMBL10175614 | 0.75 | SMN1; SMN2 (0.46) | SMN1; SMN2HDAC1HDAC8DYRK1ALMNA | |
| SCHEMBL10175617 | 0.73 | CYP11B2 (0.55) | KDM4EHTTCNR1CNR2ALDH1A1 | |
| SCHEMBL17896651 | 0.72 | CYP11B2 (0.48) | KDM4EHTTSMN1; SMN2LMNAPTGER4 | |
| SCHEMBL17896756 | 0.71 | PTGS2 (0.45) | KDM4ESMN1; SMN2HDAC1HDAC8LMNA | |
| SCHEMBL460529 | 0.69 | NAMPT (0.53) | SMN1; SMN2LMNAALDH1A1BRPF1CYP11B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |
| US-9382226-B2 | Aldosterone synthase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2016-07-05 | — | — | US | disclosed |
| WO-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | disclosed |