Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 8/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL460491 | 0.78 | CYP11B2 (0.59) | CYP11B2CYP11B1CYP19A1ADRA2BKMT2A | |
| SCHEMBL459504 | 0.71 | CYP11B2 (0.56) | CYP11B2CYP11B1CYP19A1ADRA2BTLR7 | |
| SCHEMBL17896599 | 0.71 | CYP11B2 (0.63) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL461638 | 0.71 | CYP11B2 (0.63) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL17896682 | 0.70 | CYP11B2 (0.63) | CYP11B2CYP11B1CYP19A1ADRA2BTLR7 | |
| SCHEMBL17896751 | 0.70 | MAPT (0.49) | CYP11B2CYP11B1CYP19A1KMT2AMEN1 | |
| SCHEMBL12325402 | 0.69 | HPGD (0.82) | KMT2AMEN1HPGDNPSR1CYP1A2 | |
| SCHEMBL13319281 | 0.69 | KMT2A (0.74) | KMT2AMEN1HPGDNPSR1CYP1A2 | |
| SCHEMBL17896681 | 0.68 | CYP11B2 (0.59) | CYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL459353 | 0.67 | CYP11B2 (1.00) | CYP11B2CYP11B1CYP19A1ADRA2B |
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 |