Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 3/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19705388 | 0.76 | CYP1A2 (0.41) | ELANECYP1A2CYP2A6LMNASMN1; SMN2 | |
| SCHEMBL5987050 | 0.76 | CYP1A2 (0.41) | CYP11B2CYP11B1CYP1A2CYP2A6LMNA | |
| SCHEMBL12433466 | 0.76 | CYP1A2 (0.46) | CYP11B2CYP11B1ELANEKIF11CYP1A2 | |
| SCHEMBL8404562 | 0.75 | CYP1A2 (0.52) | CYP11B2CYP11B1CYP1A2CYP2A6LMNA | |
| SCHEMBL18731280 | 0.74 | CYP11B1 (0.44) | CYP11B2CYP11B1KIF11CYP1A2SLC22A12 | |
| SCHEMBL7837604 | 0.74 | CYP2A6 (0.57) | ELANEKIF11CYP1A2CYP2A6HSD11B1 | |
| SCHEMBL11142241 | 0.73 | CYP11B2 (0.55) | CYP11B2CYP11B1CYP17A1SMN1; SMN2KDM4E | |
| SCHEMBL17981072 | 0.72 | CYP1A2 (0.41) | ELANECYP1A2CYP2A6LMNAHTT | |
| SCHEMBL30702109 | 0.72 | TDP1 (0.41) | CYP1A2CYP2A6LMNASMN1; SMN2KDM4E | |
| SCHEMBL12114723 | 0.72 | TRPA1 (0.46) | CYP1A2CYP2A6LMNASMN1; SMN2KDM4E |
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-2020056345-A1 | ARYL CYCLOPROPYL-AMINO-ISOQUINOLINYL AMIDE COMPOUNDS | AERIE PHARMACEUTICALS, INC. (US) | 2020-03-19 | — | — | WO | disclosed |