Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17624290 | 0.82 | HRH1 (0.45) | HRH1CYP1A2CYP2D6PDE5ALMNA | |
| SCHEMBL17608582 | 0.79 | F2RL3 (0.45) | KMT2AMEN1MAPTSMN1; SMN2TP53 | |
| SCHEMBL17624291 | 0.77 | ELANE (0.53) | PTGDR2PTGER1NR1H2NR1H3PLA2G2A | |
| SCHEMBL30602811 | 0.74 | PTGDR2 (0.46) | PTGDR2CYP1A2CYP2D6PDE5AKMT2A | |
| SCHEMBL30602797 | 0.74 | CNR2 (0.53) | ADRA1AHRH3PTGDR2CYP1A2CYP2D6 | |
| SCHEMBL928596 | 0.72 | SLC16A3 (0.76) | PTGDR2SLC16A3 | |
| SCHEMBL7526015 | 0.72 | SLC22A12 (0.50) | PTGDR2CYP1A2PDE5AKMT2AMEN1 | |
| SCHEMBL1216862 | 0.71 | CYP1A2 (0.51) | PTGDR2CYP1A2CYP2D6PTGER1AKR1B1 | |
| SCHEMBL15345011 | 0.71 | L3MBTL1 (0.52) | PTGDR2PDE5AKMT2AMEN1LMNA | |
| SCHEMBL30695107 | 0.70 | CNR2 (0.53) | PTGDR2CYP1A2KMT2AMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016041618-A1 | SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES | MERCK PATENT GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |
| WO-2016041618-A1 | SUBSTITUTED INDAZOLES AND RELATED HETEROCYCLES | MERCK PATENT GMBH (DE) | 2016-03-24 | — | — | WO | disclosed |