Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 6/20 | 0.60 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.51 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3158636 | 0.84 | ALDH1A1 (0.67) | ATMHTTKDM4ENPC1ALDH1A1 | |
| SCHEMBL10175606 | 0.83 | CYP11B2 (0.60) | CYP11B2CYP11B1ATMHTTNPC1 | |
| SCHEMBL10176167 | 0.83 | CYP11B2 (0.80) | CYP11B2CYP11B1ATMHTTALOX5AP | |
| SCHEMBL1378639 | 0.83 | CYP11B2 (0.62) | CYP11B2CYP11B1HTTKDM4EALDH1A1 | |
| SCHEMBL20982514 | 0.82 | KDM4E (0.68) | ATMHTTKDM4ENPC1ALDH1A1 | |
| SCHEMBL10175817 | 0.81 | RAD51 (0.60) | CYP11B2CYP11B1ATMKDM4ENPC1 | |
| SCHEMBL1104859 | 0.81 | MEN1 (0.69) | CYP11B2CYP11B1ATMHTTKDM4E | |
| SCHEMBL2251213 | 0.81 | KDM4E (0.71) | ATMHTTKDM4ENPC1ALDH1A1 | |
| SCHEMBL17883781 | 0.80 | PTGS2 (0.57) | CYP11B2CYP11B1ATMNPC1RAB9A | |
| SCHEMBL17896626 | 0.80 | HTR2B (0.67) | CYP11B2CYP11B1ATMALOX5APNAMPT |
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 |