Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10249024 | 0.86 | SMN1; SMN2 (0.47) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL30663907 | 0.82 | RAB9A (0.53) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL26603179 | 0.82 | RAB9A (0.53) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL167106 | 0.82 | PDE10A (0.46) | SMN1; SMN2POLBATMCYP11B1CYP11B2 | |
| SCHEMBL17896622 | 0.81 | CYP11B1 (0.50) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL31339766 | 0.81 | MEN1 (0.59) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL17896620 | 0.80 | SMN1; SMN2 (0.46) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL10176226 | 0.80 | CYP11B2 (0.58) | CYP11B1CYP11B2 | |
| SCHEMBL17896660 | 0.80 | CYP11B2 (0.43) | SMN1; SMN2NPC1TP53MAPTRAB9A | |
| SCHEMBL17896744 | 0.79 | CYP11B2 (0.47) | SMN1; SMN2NPC1TP53MAPTRAB9A |
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 |