Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KCNJ6 | P48051 | 4/20 | 0.32 |
| ▸ | KCNJ3 | P48549 | 4/20 | 0.32 |
| ▸ | KCNJ5 | P48544 | 3/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23213976 | 0.81 | — | — | |
| SCHEMBL19953968 | 0.79 | KDM4E (0.39) | DRD2DRD4DRD3KDM4EALDH1A1 | |
| SCHEMBL25745817 | 0.79 | KDM4E (0.42) | DRD2DRD4DRD3KDM4EALDH1A1 | |
| SCHEMBL25745828 | 0.77 | KDM4E (0.44) | KDM4EALDH1A1HSD17B10KCNJ6KCNJ3 | |
| SCHEMBL25745806 | 0.76 | KDM4E (0.40) | KDM4EALDH1A1HSD17B10KCNJ6KCNJ3 | |
| SCHEMBL19953969 | 0.75 | TGFBR1 (0.40) | DRD2DRD4DRD3TGFBR1KCNJ6 | |
| SCHEMBL19953971 | 0.75 | TRPV4 (0.41) | DRD2DRD4DRD3ALDH1A1HSD17B10 | |
| SCHEMBL15935405 | 0.72 | SMN1; SMN2 (0.41) | DRD2DRD4DRD3KDM4EALDH1A1 | |
| SCHEMBL25745827 | 0.72 | DRD2 (0.41) | DRD2DRD4DRD3ALDH1A1ADRA2A | |
| SCHEMBL24815007 | 0.71 | DRD2 (0.41) | DRD2DRD4DRD3TMEM97SIGMAR1 |
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-2021070132-A1 | BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS | JANSSEN BIOTECH, INC. (US) | 2021-04-15 | — | — | WO | disclosed |