Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.71 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.71 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.71 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.71 |
| ▸ | PGR | P06401 | 3/20 | 0.57 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.57 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.57 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.57 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.57 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.57 |
| ▸ | GRIA1 | P42261 | 3/20 | 0.54 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.54 |
| ▸ | AHR | P35869 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL6746651 | 0.87 | CYP11B1 (0.55) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL1119981 | 0.86 | CYP11B1 (0.72) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL23143482 | 0.83 | PDE3B (1.00) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL29899595 | 0.83 | CYP11B1 (1.00) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL29849827 | 0.83 | CYP11B1 (1.00) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL748904 | 0.83 | CYP11B1 (1.00) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL29849907 | 0.83 | CYP11B1 (1.00) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL1874478 | 0.82 | CYP1A2 (0.64) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL3132725 | 0.80 | PGR (0.73) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 | |
| SCHEMBL18189648 | 0.79 | GRIA1 (0.56) | PDE3BPDE3ACYP11B1CYP11B2CYP1A2 |
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-2020142486-A1 | KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE | ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) | 2020-07-09 | — | — | WO | disclosed |