Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.79 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.67 |
| ▸ | HPGD | P15428 | 4/20 | 0.67 |
| ▸ | NPC1 | O15118 | 3/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | STAT1 | P42224 | 1/20 | 0.67 |
| ▸ | LDHA | P00338 | 1/20 | 0.66 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | RET | P07949 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3340830 | 0.83 | KDM4E (0.65) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL3333868 | 0.82 | KDM4E (0.67) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL3541175 | 0.82 | MAPT (0.79) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL3424059 | 0.82 | MAPT (0.67) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL8054731 | 0.82 | MAPT (0.67) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL5683118 | 0.82 | DGAT1 (0.73) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL16499476 | 0.81 | ALDH1A1 (0.65) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL7289805 | 0.81 | MAPT (0.69) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL11231437 | 0.80 | KDM4E (0.76) | CYP11B1KDM4EMAPTALDH1A1RAB9A | |
| SCHEMBL1519746 | 0.80 | KDM4E (1.00) | CYP11B1KDM4EMAPTALDH1A1RAB9A |
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-2012012478-A1 | ALDOSTERONE SYNTHASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2012-01-26 | — | — | WO | disclosed |