Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H3 | Q13133 | 1/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | APAF1 | O14727 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10925870 | 1.00 | NR1H3 (0.53) | NR1H3ADRA1DADRA1AADRA1BALOX15 | |
| SCHEMBL10927612 | 0.88 | NR1H3 (0.58) | NR1H3ADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL10927617 | 0.88 | NR1H3 (0.58) | NR1H3ADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL10921614 | 0.84 | NR1H3 (0.50) | NR1H3ADRA1DADRA1AADRA1BKMT2A | |
| SCHEMBL10921613 | 0.84 | NR1H3 (0.50) | NR1H3ADRA1DADRA1AADRA1BKMT2A | |
| SCHEMBL10919942 | 0.82 | NR1H3 (0.52) | NR1H3ADRA1DADRA1AADRA1BKMT2A | |
| SCHEMBL10919941 | 0.82 | NR1H3 (0.52) | NR1H3ADRA1DADRA1AADRA1BKMT2A | |
| SCHEMBL5784952 | 0.80 | ADRA1D (0.64) | ADRA1DADRA1AADRA1BKMT2ACA12 | |
| SCHEMBL10919964 | 0.80 | ADRA1D (0.47) | NR1H3ADRA1DADRA1AADRA1BKMT2A | |
| SCHEMBL10919966 | 0.80 | ADRA1D (0.47) | NR1H3ADRA1DADRA1AADRA1BKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4598077-A | Amidine derivatives and cardiotonic compositions | TORII & CO. LTD. (JP) | 1986-07-01 | — | — | US | disclosed |