Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31364464 | 0.94 | KMT2A (0.56) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL4379040 | 0.94 | KMT2A (0.56) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL10926803 | 0.93 | ADRA1D (0.55) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL10925461 | 0.90 | ADRA1D (0.58) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL21997738 | 0.86 | CASP3 (0.55) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL10927830 | 0.83 | KMT2A (0.48) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL10927835 | 0.83 | KMT2A (0.48) | KMT2ACASP3ADRA1DADRA1AADRA1B | |
| SCHEMBL2258501 | 0.82 | KMT2A (0.70) | KMT2ACASP3NPSR1PKMTSHR | |
| SCHEMBL16862983 | 0.81 | KDM4E (0.66) | KMT2AADRA1DADRA1AADRA1BGRM5 | |
| SCHEMBL236787 | 0.80 | TDP1 (0.52) | CASP3GRM5L3MBTL1PKMTSHR |
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 |