Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | P4HB | P07237 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10919964 | 1.00 | ADRA1D (0.47) | ADRA1DADRA1AADRA1BNR1H3HDAC1 | |
| SCHEMBL10927830 | 0.91 | KMT2A (0.48) | ADRA1DADRA1AADRA1BNR1H3CASP3 | |
| SCHEMBL10927835 | 0.91 | KMT2A (0.48) | ADRA1DADRA1AADRA1BNR1H3CASP3 | |
| SCHEMBL10927617 | 0.88 | NR1H3 (0.58) | ADRA1DADRA1AADRA1BNR1H3HDAC1 | |
| SCHEMBL10927612 | 0.88 | NR1H3 (0.58) | ADRA1DADRA1AADRA1BNR1H3HDAC1 | |
| SCHEMBL10919941 | 0.88 | NR1H3 (0.52) | ADRA1DADRA1AADRA1BNR1H3HDAC1 | |
| SCHEMBL10919942 | 0.88 | NR1H3 (0.52) | ADRA1DADRA1AADRA1BNR1H3HDAC1 | |
| SCHEMBL4379040 | 0.81 | KMT2A (0.56) | ADRA1DADRA1AADRA1BCASP3NPSR1 | |
| SCHEMBL31364464 | 0.81 | KMT2A (0.56) | ADRA1DADRA1AADRA1BCASP3NPSR1 | |
| SCHEMBL10926803 | 0.81 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BNR1H3HDAC1 |
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 |