Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | KIT | P10721 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 8/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 7/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10175602 | 0.90 | HTR2B (0.51) | HTR2BHTR6KITCYP11B2CYP11B1 | |
| SCHEMBL17896629 | 0.86 | PTGS2 (0.49) | HTR2BHTR6KITCYP11B2CYP11B1 | |
| SCHEMBL17896718 | 0.85 | CYP11B2 (0.56) | HTR2BCYP11B2CYP11B1CYP19A1ADRA2B | |
| SCHEMBL17896627 | 0.84 | PTGS2 (0.51) | HTR2BHTR6KITCYP11B2CYP11B1 | |
| SCHEMBL17896630 | 0.82 | NPBWR1 (0.48) | HTR2BHTR6KITCYP11B2CYP11B1 | |
| SCHEMBL17896626 | 0.82 | HTR2B (0.67) | HTR2BHTR6KITCYP11B2CYP11B1 | |
| SCHEMBL17896665 | 0.82 | KDM4E (0.52) | CYP11B2CYP11B1CYP19A1ADRA2BKDM4E | |
| SCHEMBL17896619 | 0.82 | NPC1 (0.51) | CYP11B2CYP11B1CYP19A1ADRA2BMEN1 | |
| SCHEMBL167098 | 0.81 | MEN1 (0.57) | HTR2BHTR6KITAGPAT2KDM4E | |
| SCHEMBL10175815 | 0.80 | CYP11B1 (0.48) | CYP11B2CYP11B1CYP19A1ADRA2BTDP1 |
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 2 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 |