Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | ADRB3 | P13945 | 6/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | CASR | P41180 | 2/20 | 0.54 |
| ▸ | ADRB2 | P07550 | 6/20 | 0.50 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL7368932 | 0.86 | CASR (0.51) | KDM4EADRB3MAPK1ALDH1A1KMT2A | |
| SCHEMBL7367965 | 0.86 | ADRB3 (0.60) | KDM4EADRB3ALDH1A1KMT2AADRB2 | |
| SCHEMBL7364771 | 0.84 | MEN1 (0.62) | ADRB3KMT2AADRB2ADRB1 | |
| SCHEMBL7367538 | 0.84 | MEN1 (0.62) | ADRB3KMT2AADRB2ADRB1 | |
| SCHEMBL7367855 | 0.83 | MEN1 (0.63) | ADRB3KMT2AADRB2ADRB1 | |
| SCHEMBL7365119 | 0.80 | KDM4E (0.56) | KDM4EADRB3MAPK1ALDH1A1KMT2A | |
| SCHEMBL6690111 | 0.79 | MEN1 (0.65) | ADRB3KMT2AADRB2ADRB1 | |
| SCHEMBL22640124 | 0.77 | KDM4E (1.00) | KDM4EADRB3TSHRMAPK1ALDH1A1 | |
| SCHEMBL22640088 | 0.77 | KDM4E (1.00) | KDM4EADRB3TSHRMAPK1ALDH1A1 | |
| SCHEMBL18506356 | 0.77 | KDM4E (0.56) | KDM4EADRB3TSHRMAPK1ALDH1A1 |
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-1994002463-A1 | ANTIHYPERTENSIVE 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-02-03 | — | — | WO | disclosed |