Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 11/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.39 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.38 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.38 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.38 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9350057 | 0.83 | ADRA2A (0.38) | HDAC4ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL6946930 | 0.75 | ABCC9 (0.50) | CACNA1BABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL28745624 | 0.74 | CACNA1B (0.57) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL15442862 | 0.73 | HDAC4 (0.48) | HDAC4CTNNB1WNT3ASMYD3MRGPRX4 | |
| SCHEMBL15443441 | 0.73 | HDAC4 (0.48) | HDAC4CTNNB1WNT3ASMYD3MRGPRX4 | |
| SCHEMBL8949674 | 0.72 | CACNA1F (0.53) | CACNA1BABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL9505147 | 0.72 | ADRA2A (0.51) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL27541931 | 0.72 | CACNA1B (0.49) | HDAC4CACNA1B | |
| SCHEMBL8699921 | 0.71 | CACNA1B (0.65) | CACNA1B | |
| SCHEMBL30932230 | 0.71 | ALDH1A1 (0.64) | CACNA1B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5344944-A | Cardiovascular insufficiency, increasing the contractive force of the heart | BAYER AKTIENGESELLSCHAFT (DE) | 1994-09-06 | — | — | US | disclosed |
| US-4886816-A | CARDIOTONIC AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 1989-12-12 | — | — | US | disclosed |